target,target_id,target_uniprot,target_species,ligand,ligand_id,ligand_species,ligand_pubchem_cid,smiles,inchi,inchikey,type,action,action_comment,endogenous,primary_target,concentration_range,affinity_parameter,affinity_high,affinity_median,affinity_low,original_affinity_units,original_affinity_low_nm,original_affinity_median_nm,original_affinity_high_nm,original_affinity_relation,assay_description,receptor_site,ligand_context,pubmed_id BB1 receptor,38,P24053,Rat,gastrin-releasing peptide,612,Human,,,,,Agonist,Full agonist,,,,,pKi,6.39,,6.36,Ki,440.0,,403.0,=,,,,10454496|7838118|9325344|10353842, BB1 receptor,38,P28336,Human,neuromedin B,613,"Human, Mouse, Rat, Pig",4345957,CSCCC(C(=O)N)NC(=O)C(NC(=O)C(Cc1[nH]cnc1)NC(=O)CNC(=O)C(C(O)C)NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C(NC(=O)CN)CC(=O)N)CC(C)C)C)Cc1ccccc1,"InChI=1S/C52H73N15O12S/c1-27(2)17-36(64-51(78)40(21-41(54)69)61-42(70)22-53)48(75)66-38(19-31-23-57-34-14-10-9-13-33(31)34)47(74)60-28(3)46(73)67-44(29(4)68)52(79)58-25-43(71)62-39(20-32-24-56-26-59-32)50(77)65-37(18-30-11-7-6-8-12-30)49(76)63-35(45(55)72)15-16-80-5/h6-14,23-24,26-29,35-40,44,57,68H,15-22,25,53H2,1-5H3,(H2,54,69)(H2,55,72)(H,56,59)(H,58,79)(H,60,74)(H,61,70)(H,62,71)(H,63,76)(H,64,78)(H,65,77)(H,66,75)(H,67,73)",YPFNACALNKVZNK-UHFFFAOYSA-N,Agonist,Full agonist,,yes,,,pKi,10.3,,8.1,Ki,7.9,,0.05,=,,,,18055507|21729729|25976083, BB1 receptor,38,P24053,Rat,[Phe13]bombesin,615,,,,,,Agonist,Full agonist,,,,,pKi,8.22,,6.46,Ki,350.0,,6.0,=,,,,10454496|9325344|10353842, BB1 receptor,38,P28336,Human,bombesin,616,,16133800,CSCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CCC(=O)N)CCCNC(=N)N)CC(C)C)CC(=O)N)CCC(=O)N)C)CC(C)C,"InChI=1S/C71H110N24O18S/c1-34(2)24-47(92-62(105)43(14-11-22-79-71(76)77)89-64(107)45(15-18-52(72)96)90-63(106)44-17-20-55(99)85-44)61(104)81-31-56(100)87-51(28-54(74)98)69(112)91-46(16-19-53(73)97)65(108)94-49(26-38-29-80-41-13-10-9-12-40(38)41)66(109)84-37(7)60(103)95-58(36(5)6)70(113)82-32-57(101)86-50(27-39-30-78-33-83-39)68(111)93-48(25-35(3)4)67(110)88-42(59(75)102)21-23-114-8/h9-10,12-13,29-30,33-37,42-51,58,80H,11,14-28,31-32H2,1-8H3,(H2,72,96)(H2,73,97)(H2,74,98)(H2,75,102)(H,78,83)(H,81,104)(H,82,113)(H,84,109)(H,85,99)(H,86,101)(H,87,100)(H,88,110)(H,89,107)(H,90,106)(H,91,112)(H,92,105)(H,93,111)(H,94,108)(H,95,103)(H4,76,77,79)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,58-/m0/s1",QXZBMSIDSOZZHK-DOPDSADYSA-N,Agonist,Full agonist,,,,,pIC50,8.75,,8.43,IC50,3.7,,1.77,=,,,,21729729, BB1 receptor,38,P28336,Human,bombesin,616,,16133800,CSCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CCC(=O)N)CCCNC(=N)N)CC(C)C)CC(=O)N)CCC(=O)N)C)CC(C)C,"InChI=1S/C71H110N24O18S/c1-34(2)24-47(92-62(105)43(14-11-22-79-71(76)77)89-64(107)45(15-18-52(72)96)90-63(106)44-17-20-55(99)85-44)61(104)81-31-56(100)87-51(28-54(74)98)69(112)91-46(16-19-53(73)97)65(108)94-49(26-38-29-80-41-13-10-9-12-40(38)41)66(109)84-37(7)60(103)95-58(36(5)6)70(113)82-32-57(101)86-50(27-39-30-78-33-83-39)68(111)93-48(25-35(3)4)67(110)88-42(59(75)102)21-23-114-8/h9-10,12-13,29-30,33-37,42-51,58,80H,11,14-28,31-32H2,1-8H3,(H2,72,96)(H2,73,97)(H2,74,98)(H2,75,102)(H,78,83)(H,81,104)(H,82,113)(H,84,109)(H,85,99)(H,86,101)(H,87,100)(H,88,110)(H,89,107)(H,90,106)(H,91,112)(H,92,105)(H,93,111)(H,94,108)(H,95,103)(H4,76,77,79)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,58-/m0/s1",QXZBMSIDSOZZHK-DOPDSADYSA-N,Agonist,Full agonist,,,,,pKi,7.49,,7.47,Ki,34.0,,32.0,=,,,,10454496|7838118, BB1 receptor,38,P24053,Rat,bombesin,616,,16133800,CSCC[C@@H](C(=O)N)NC(=O)[C@@H](NC(=O)[C@H](Cc1nc[nH]c1)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CCC(=O)N)CCCNC(=N)N)CC(C)C)CC(=O)N)CCC(=O)N)C)CC(C)C,"InChI=1S/C71H110N24O18S/c1-34(2)24-47(92-62(105)43(14-11-22-79-71(76)77)89-64(107)45(15-18-52(72)96)90-63(106)44-17-20-55(99)85-44)61(104)81-31-56(100)87-51(28-54(74)98)69(112)91-46(16-19-53(73)97)65(108)94-49(26-38-29-80-41-13-10-9-12-40(38)41)66(109)84-37(7)60(103)95-58(36(5)6)70(113)82-32-57(101)86-50(27-39-30-78-33-83-39)68(111)93-48(25-35(3)4)67(110)88-42(59(75)102)21-23-114-8/h9-10,12-13,29-30,33-37,42-51,58,80H,11,14-28,31-32H2,1-8H3,(H2,72,96)(H2,73,97)(H2,74,98)(H2,75,102)(H,78,83)(H,81,104)(H,82,113)(H,84,109)(H,85,99)(H,86,101)(H,87,100)(H,88,110)(H,89,107)(H,90,106)(H,91,112)(H,92,105)(H,93,111)(H,94,108)(H,95,103)(H4,76,77,79)/t37-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,58-/m0/s1",QXZBMSIDSOZZHK-DOPDSADYSA-N,Agonist,Full agonist,,,,,pKi,7.68,,7.47,Ki,34.0,,21.0,=,,,,10454496|7838118, BB1 receptor,38,P24053,Rat,litorin,617,,14235547,,,,Agonist,Full agonist,,,,,pKi,,8.15,,Ki,,7.0,,=,,,,9325344|10353842, BB1 receptor,38,P28336,Human,ranatensin,618,,22146595,CSCCC(C(=O)N)NC(=O)C(NC(=O)C(Cc1[nH]cnc1)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C1CCC(=O)N1)CCC(=O)N)C)Cc1ccccc1,"InChI=1S/C61H84N16O13S/c1-32(2)50(60(89)66-30-49(80)70-45(27-37-29-64-31-67-37)58(87)73-43(25-35-13-8-7-9-14-35)57(86)71-40(52(63)81)22-24-91-6)75-53(82)34(5)68-56(85)44(26-36-28-65-39-16-11-10-15-38(36)39)74-54(83)42(18-20-47(62)78)72-59(88)46-17-12-23-77(46)61(90)51(33(3)4)76-55(84)41-19-21-48(79)69-41/h7-11,13-16,28-29,31-34,40-46,50-51,65H,12,17-27,30H2,1-6H3,(H2,62,78)(H2,63,81)(H,64,67)(H,66,89)(H,68,85)(H,69,79)(H,70,80)(H,71,86)(H,72,88)(H,73,87)(H,74,83)(H,75,82)(H,76,84)",AUOCWSNQHWTPIJ-UHFFFAOYSA-N,Agonist,Full agonist,,,,,pIC50,8.83,,8.35,IC50,4.47,,1.48,=,,,,21729729, BB1 receptor,38,P24053,Rat,ranatensin,618,,22146595,CSCCC(C(=O)N)NC(=O)C(NC(=O)C(Cc1[nH]cnc1)NC(=O)CNC(=O)C(C(C)C)NC(=O)C(NC(=O)C(Cc1c[nH]c2c1cccc2)NC(=O)C(NC(=O)C1CCCN1C(=O)C(C(C)C)NC(=O)C1CCC(=O)N1)CCC(=O)N)C)Cc1ccccc1,"InChI=1S/C61H84N16O13S/c1-32(2)50(60(89)66-30-49(80)70-45(27-37-29-64-31-67-37)58(87)73-43(25-35-13-8-7-9-14-35)57(86)71-40(52(63)81)22-24-91-6)75-53(82)34(5)68-56(85)44(26-36-28-65-39-16-11-10-15-38(36)39)74-54(83)42(18-20-47(62)78)72-59(88)46-17-12-23-77(46)61(90)51(33(3)4)76-55(84)41-19-21-48(79)69-41/h7-11,13-16,28-29,31-34,40-46,50-51,65H,12,17-27,30H2,1-6H3,(H2,62,78)(H2,63,81)(H,64,67)(H,66,89)(H,68,85)(H,69,79)(H,70,80)(H,71,86)(H,72,88)(H,73,87)(H,74,83)(H,75,82)(H,76,84)",AUOCWSNQHWTPIJ-UHFFFAOYSA-N,Agonist,Full agonist,,,,,pKi,,7.89,,Ki,,13.0,,=,,,,9325344|10353842, BB1 receptor,38,P28336,Human,PD 165929,620,,5311352,O=C(N[C@](C(=O)NCC1(CCCCC1)c1ccccn1)(Cc1c[nH]c2c1cccc2)C)Nc1c(cccc1C(C)C)C(C)C,"InChI=1S/C37H47N5O2/c1-25(2)28-15-13-16-29(26(3)4)33(28)41-35(44)42-36(5,22-27-23-39-31-17-8-7-14-30(27)31)34(43)40-24-37(19-10-6-11-20-37)32-18-9-12-21-38-32/h7-9,12-18,21,23,25-26,39H,6,10-11,19-20,22,24H2,1-5H3,(H,40,43)(H2,41,42,44)/t36-/m0/s1",RVCSRPVACXMJEL-BHVANESWSA-N,Antagonist,Antagonist,,,,,pKd,,8.2,,Kd,,6.31,,=,,,,, BB1 receptor,38,P28336,Human,PD 168368,621,,9937534,O=C(N[C@](C(=O)NCC1(CCCCC1)c1ccccn1)(Cc1c[nH]c2c1cccc2)C)Nc1ccc(cc1)[N+](=O)[O-],"InChI=1S/C31H34N6O4/c1-30(19-22-20-33-26-10-4-3-9-25(22)26,36-29(39)35-23-12-14-24(15-13-23)37(40)41)28(38)34-21-31(16-6-2-7-17-31)27-11-5-8-18-32-27/h3-5,8-15,18,20,33H,2,6-7,16-17,19,21H2,1H3,(H,34,38)(H2,35,36,39)/t30-/m0/s1",AFDXUTWMFMAQJO-PMERELPUSA-N,Antagonist,Antagonist,,,,,pIC50,9.6,,9.29,IC50,0.51,,0.25,=,,,,19463875, BB1 receptor,38,P24053,Rat,PD 168368,621,,9937534,O=C(N[C@](C(=O)NCC1(CCCCC1)c1ccccn1)(Cc1c[nH]c2c1cccc2)C)Nc1ccc(cc1)[N+](=O)[O-],"InChI=1S/C31H34N6O4/c1-30(19-22-20-33-26-10-4-3-9-25(22)26,36-29(39)35-23-12-14-24(15-13-23)37(40)41)28(38)34-21-31(16-6-2-7-17-31)27-11-5-8-18-32-27/h3-5,8-15,18,20,33H,2,6-7,16-17,19,21H2,1H3,(H,34,38)(H2,35,36,39)/t30-/m0/s1",AFDXUTWMFMAQJO-PMERELPUSA-N,Antagonist,Antagonist,,,,,pIC50,7.41,,7.35,IC50,45.0,,39.0,=,,,,10454496, BB1 receptor,38,P24053,Rat,kuwanon H,622,,5281668,CC(=CCc1c(O)ccc(c1O)C(=O)[C@H]1[C@@H](CC(=C[C@@H]1c1c(O)cc(c2c1oc(c1ccc(cc1O)O)c(c2=O)CC=C(C)C)O)C)c1ccc(cc1O)O)C,"InChI=1S/C45H44O11/c1-21(2)6-10-27-33(48)15-14-29(41(27)53)42(54)38-31(26-12-8-24(46)18-34(26)49)16-23(5)17-32(38)39-36(51)20-37(52)40-43(55)30(11-7-22(3)4)44(56-45(39)40)28-13-9-25(47)19-35(28)50/h6-9,12-15,17-20,31-32,38,46-53H,10-11,16H2,1-5H3/t31-,32-,38-/m0/s1",DKBPTKFKCCNXNH-QXGWMLRCSA-N,Antagonist,Antagonist,,,,,pKi,,5.19,,Ki,,6500.0,,=,,,,7646517, BB1 receptor,38,P28336,Human,[125I][Tyr4]bombesin,623,,,,,,Agonist,Full agonist,,,,,,,,,,,,,=,,,,, BB1 receptor,38,P24053,Rat,JMV594,624,,,,,,Antagonist,Antagonist,,,,,pIC50,,5.0,,IC50,,10000.0,,>,,,,11463790, BB1 receptor,38,P28336,Human,PD 176252,626,,9829828,COc1ccc(nc1)C1(CCCCC1)CNC(=O)[C@](Cc1c[nH]c2c1cccc2)(NC(=O)Nc1ccc(cc1)[N+](=O)[O-])C,"InChI=1S/C32H36N6O5/c1-31(18-22-19-33-27-9-5-4-8-26(22)27,37-30(40)36-23-10-12-24(13-11-23)38(41)42)29(39)35-21-32(16-6-3-7-17-32)28-15-14-25(43-2)20-34-28/h4-5,8-15,19-20,33H,3,6-7,16-18,21H2,1-2H3,(H,35,39)(H2,36,37,40)/t31-/m0/s1",NNFUWNLENRUDHR-HKBQPEDESA-N,Antagonist,Antagonist,,,,,pIC50,9.77,,9.28,IC50,0.53,,0.17,=,,,,19463875, BB1 receptor,38,P28336,Human,"[D-Phe6,β-Ala11,Phe13,Nle14]bombesin-(6-14)",632,,,,,,Agonist,Full agonist,,,,,pIC50,9.68,,9.49,IC50,0.32,,0.21,=,,,,21729729, BB1 receptor,38,P28336,Human,"[D-Phe6,β-Ala11,Phe13,Nle14]bombesin-(6-14)",632,,,,,,Agonist,Full agonist,,,,,pKi,9.7,,7.8,,,,,=,,,,10454496|21729729, BB1 receptor,38,P28336,Human,D-Nal-Cys-Tyr-D-Trp-Lys-Val-Cys-Nal-NH2,635,,,,,,Antagonist,Antagonist,,,,,pIC50,6.56,,6.22,IC50,605.0,,275.0,=,,,,19463875, BB1 receptor,38,P24053,Rat,D-Nal-Cys-Tyr-D-Trp-Lys-Val-Cys-Nal-NH2,635,,,,,,Antagonist,Antagonist,,,,,pIC50,,6.0,,IC50,,997.0,,=,,,,7901752, BB1 receptor,38,P24053,Rat,D-Nal-Cys-Tyr-D-Trp-Lys-Val-Cys-Nal-NH2,635,,,,,,Antagonist,Antagonist,,,,,pKi,7.23,,6.66,Ki,220.0,,59.0,=,,,,10454496, BB1 receptor,38,P28336,Human,"[125I]BH-NMB (human, mouse, rat)",3771,,6324606,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CN)[C@@H](C)O)C(N)=O,"InChI=1S/C52H73N15O12S/c1-27(2)17-36(64-51(78)40(21-41(54)69)61-42(70)22-53)48(75)66-38(19-31-23-57-34-14-10-9-13-33(31)34)47(74)60-28(3)46(73)67-44(29(4)68)52(79)58-25-43(71)62-39(20-32-24-56-26-59-32)50(77)65-37(18-30-11-7-6-8-12-30)49(76)63-35(45(55)72)15-16-80-5/h6-14,23-24,26-29,35-40,44,57,68H,15-22,25,53H2,1-5H3,(H2,54,69)(H2,55,72)(H,56,59)(H,58,79)(H,60,74)(H,61,70)(H,62,71)(H,63,76)(H,64,78)(H,65,77)(H,66,75)(H,67,73)/t28-,29+,35-,36-,37-,38-,39-,40-,44-/m0/s1",YPFNACALNKVZNK-MFNIMNRCSA-N,Agonist,Full agonist,,,,,,,,,,,,,=,,,,, BB1 receptor,38,P28336,Human,"[D-Phe6, Leu13, Cpa14,ψ13-14]bombesin-(6-14)",3840,,,,,,Antagonist,Antagonist,,,,,pIC50,,5.0,,IC50,,10000.0,,>,,,,19463875, BB1 receptor,38,P24053,Rat,JMV641,3889,,,,,,Antagonist,Antagonist,,,,,pIC50,,5.82,,IC50,,1500.0,,=,,,,11463790, BB1 receptor,38,P28336,Human,neuromedin B (1-30) (human),6163,,,,,,Agonist,Full agonist,,,,,pIC50,9.7,,9.52,IC50,0.304,,0.198,=,,,,21729729, BB1 receptor,38,P28336,Human,Rhodei-litorin,6165,,57340152,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,"InChI=1S/C51H71N13O12S/c1-27(2)19-37(61-45(69)34(52)15-16-41(53)66)47(71)63-39(21-31-23-55-35-14-10-9-13-33(31)35)46(70)58-28(3)44(68)64-43(29(4)65)50(74)56-25-42(67)59-40(22-32-24-54-26-57-32)49(73)62-38(20-30-11-7-6-8-12-30)48(72)60-36(51(75)76)17-18-77-5/h6-14,23-24,26-29,34,36-40,43,55,65H,15-22,25,52H2,1-5H3,(H2,53,66)(H,54,57)(H,56,74)(H,58,70)(H,59,67)(H,60,72)(H,61,69)(H,62,73)(H,63,71)(H,64,68)(H,75,76)/t28-,29+,34-,36-,37-,38-,39-,40-,43-/m0/s1",SVUYIHOQEOWECO-SRURJFDISA-N,Agonist,Full agonist,,,,,pIC50,9.75,,9.59,IC50,0.26,,0.178,=,,,,21729729, BB1 receptor,38,P24053,Rat,Rhodei-litorin,6165,,57340152,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,"InChI=1S/C51H71N13O12S/c1-27(2)19-37(61-45(69)34(52)15-16-41(53)66)47(71)63-39(21-31-23-55-35-14-10-9-13-33(31)35)46(70)58-28(3)44(68)64-43(29(4)65)50(74)56-25-42(67)59-40(22-32-24-54-26-57-32)49(73)62-38(20-30-11-7-6-8-12-30)48(72)60-36(51(75)76)17-18-77-5/h6-14,23-24,26-29,34,36-40,43,55,65H,15-22,25,52H2,1-5H3,(H2,53,66)(H,54,57)(H,56,74)(H,58,70)(H,59,67)(H,60,72)(H,61,69)(H,62,73)(H,63,71)(H,64,68)(H,75,76)/t28-,29+,34-,36-,37-,38-,39-,40-,43-/m0/s1",SVUYIHOQEOWECO-SRURJFDISA-N,Agonist,Full agonist,,,,,pIC50,,8.99,,IC50,,1.02,,=,,,,21729729, BB1 receptor,38,P24053,Rat,Rhodei-litorin,6165,,57340152,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)[C@@H](C)O)C(=O)O,"InChI=1S/C51H71N13O12S/c1-27(2)19-37(61-45(69)34(52)15-16-41(53)66)47(71)63-39(21-31-23-55-35-14-10-9-13-33(31)35)46(70)58-28(3)44(68)64-43(29(4)65)50(74)56-25-42(67)59-40(22-32-24-54-26-57-32)49(73)62-38(20-30-11-7-6-8-12-30)48(72)60-36(51(75)76)17-18-77-5/h6-14,23-24,26-29,34,36-40,43,55,65H,15-22,25,52H2,1-5H3,(H2,53,66)(H,54,57)(H,56,74)(H,58,70)(H,59,67)(H,60,72)(H,61,69)(H,62,73)(H,63,71)(H,64,68)(H,75,76)/t28-,29+,34-,36-,37-,38-,39-,40-,43-/m0/s1",SVUYIHOQEOWECO-SRURJFDISA-N,Agonist,Full agonist,,,,,pKi,,6.34,,Ki,,460.0,,=,,,,9325344|10353842, BB1 receptor,38,P28336,Human,phyllolitorin,6166,,155817489,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O,"InChI=1S/C49H71N11O12S/c1-26(2)20-35(57-43(65)32(50)16-17-39(51)62)45(67)59-37(22-30-23-52-33-15-11-10-14-31(30)33)44(66)54-28(5)42(64)60-41(27(3)4)48(70)53-24-40(63)55-38(25-61)47(69)58-36(21-29-12-8-7-9-13-29)46(68)56-34(49(71)72)18-19-73-6/h7-15,23,26-28,32,34-38,41,52,61H,16-22,24-25,50H2,1-6H3,(H2,51,62)(H,53,70)(H,54,66)(H,55,63)(H,56,68)(H,57,65)(H,58,69)(H,59,67)(H,60,64)(H,71,72)/t28-,32-,34-,35-,36-,37-,38-,41-/m0/s1",SNQDMSYYFPNXBD-QLGZLCMKSA-N,Agonist,Full agonist,,,,,pIC50,8.64,,8.63,IC50,2.34,,2.3,=,,,,21729729, BB1 receptor,38,P24053,Rat,phyllolitorin,6166,,155817489,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O,"InChI=1S/C49H71N11O12S/c1-26(2)20-35(57-43(65)32(50)16-17-39(51)62)45(67)59-37(22-30-23-52-33-15-11-10-14-31(30)33)44(66)54-28(5)42(64)60-41(27(3)4)48(70)53-24-40(63)55-38(25-61)47(69)58-36(21-29-12-8-7-9-13-29)46(68)56-34(49(71)72)18-19-73-6/h7-15,23,26-28,32,34-38,41,52,61H,16-22,24-25,50H2,1-6H3,(H2,51,62)(H,53,70)(H,54,66)(H,55,63)(H,56,68)(H,57,65)(H,58,69)(H,59,67)(H,60,64)(H,71,72)/t28-,32-,34-,35-,36-,37-,38-,41-/m0/s1",SNQDMSYYFPNXBD-QLGZLCMKSA-N,Agonist,Full agonist,,,,,pIC50,,7.69,,IC50,,20.4,,=,,,,21729729, BB1 receptor,38,P24053,Rat,phyllolitorin,6166,,155817489,CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O,"InChI=1S/C49H71N11O12S/c1-26(2)20-35(57-43(65)32(50)16-17-39(51)62)45(67)59-37(22-30-23-52-33-15-11-10-14-31(30)33)44(66)54-28(5)42(64)60-41(27(3)4)48(70)53-24-40(63)55-38(25-61)47(69)58-36(21-29-12-8-7-9-13-29)46(68)56-34(49(71)72)18-19-73-6/h7-15,23,26-28,32,34-38,41,52,61H,16-22,24-25,50H2,1-6H3,(H2,51,62)(H,53,70)(H,54,66)(H,55,63)(H,56,68)(H,57,65)(H,58,69)(H,59,67)(H,60,64)(H,71,72)/t28-,32-,34-,35-,36-,37-,38-,41-/m0/s1",SNQDMSYYFPNXBD-QLGZLCMKSA-N,Agonist,Full agonist,,,,,pKi,,7.33,,Ki,,47.0,,=,,,,9325344|10353842, BB1 receptor,38,P28336,Human,[Leu8]-phyllolitorin,6168,,155817490,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O,"InChI=1S/C46H73N11O12S/c1-23(2)17-32(54-40(62)29(47)13-14-36(48)59)43(65)56-34(19-27-20-49-30-12-10-9-11-28(27)30)41(63)51-26(7)39(61)57-38(25(5)6)45(67)50-21-37(60)52-35(22-58)44(66)55-33(18-24(3)4)42(64)53-31(46(68)69)15-16-70-8/h9-12,20,23-26,29,31-35,38,49,58H,13-19,21-22,47H2,1-8H3,(H2,48,59)(H,50,67)(H,51,63)(H,52,60)(H,53,64)(H,54,62)(H,55,66)(H,56,65)(H,57,61)(H,68,69)/t26-,29-,31-,32-,33-,34-,35-,38-/m0/s1",SJZDDUZIBZZQHY-DLDZJLLMSA-N,Agonist,Full agonist,,,,,pIC50,6.53,,6.51,IC50,309.0,,295.0,=,,,,, BB1 receptor,38,P24053,Rat,[Leu8]-phyllolitorin,6168,,155817490,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O,"InChI=1S/C46H73N11O12S/c1-23(2)17-32(54-40(62)29(47)13-14-36(48)59)43(65)56-34(19-27-20-49-30-12-10-9-11-28(27)30)41(63)51-26(7)39(61)57-38(25(5)6)45(67)50-21-37(60)52-35(22-58)44(66)55-33(18-24(3)4)42(64)53-31(46(68)69)15-16-70-8/h9-12,20,23-26,29,31-35,38,49,58H,13-19,21-22,47H2,1-8H3,(H2,48,59)(H,50,67)(H,51,63)(H,52,60)(H,53,64)(H,54,62)(H,55,66)(H,56,65)(H,57,61)(H,68,69)/t26-,29-,31-,32-,33-,34-,35-,38-/m0/s1",SJZDDUZIBZZQHY-DLDZJLLMSA-N,Agonist,Full agonist,,,,,pIC50,,6.84,,IC50,,145.0,,=,,,,21729729, BB1 receptor,38,P24053,Rat,[Leu8]-phyllolitorin,6168,,155817490,CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC(N)=O)C(C)C)C(=O)O,"InChI=1S/C46H73N11O12S/c1-23(2)17-32(54-40(62)29(47)13-14-36(48)59)43(65)56-34(19-27-20-49-30-12-10-9-11-28(27)30)41(63)51-26(7)39(61)57-38(25(5)6)45(67)50-21-37(60)52-35(22-58)44(66)55-33(18-24(3)4)42(64)53-31(46(68)69)15-16-70-8/h9-12,20,23-26,29,31-35,38,49,58H,13-19,21-22,47H2,1-8H3,(H2,48,59)(H,50,67)(H,51,63)(H,52,60)(H,53,64)(H,54,62)(H,55,66)(H,56,65)(H,57,61)(H,68,69)/t26-,29-,31-,32-,33-,34-,35-,38-/m0/s1",SJZDDUZIBZZQHY-DLDZJLLMSA-N,Agonist,Full agonist,,,,,pKi,,5.0,,Ki,,10000.0,,>,,,,9325344|10353842, BB1 receptor,38,P28336,Human,MK-5046,6170,,49871766,FC([C@@](c1ccc(cc1)n1cccn1)(Cc1ncc([nH]1)CC1(CC1)C(F)(F)F)O)(F)F,"InChI=1S/C20H18F6N4O/c21-19(22,23)17(6-7-17)10-14-12-27-16(29-14)11-18(31,20(24,25)26)13-2-4-15(5-3-13)30-9-1-8-28-30/h1-5,8-9,12,31H,6-7,10-11H2,(H,27,29)/t18-/m0/s1",UJINBEQCDMOAHM-SFHVURJKSA-N,Agonist,Full agonist,,,,,pIC50,,5.0,,IC50,,10000.0,,>,,,,23892571|21036912, BB1 receptor,38,P28336,Human,"D-Nal,Cys,Tyr,D-Trp,Orn,Val,Cys,Nal-NH2 ",6172,,,,,,Antagonist,Antagonist,,,,,pIC50,6.33,,6.2,IC50,630.0,,468.0,=,,,,19463875, BB1 receptor,38,P28336,Human,gastrin releasing peptide(14-27) (human),6175,,155817491,CSCC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C,"InChI=1S/C75H109N23O17S2/c1-39(2)26-52(67(107)92-51(74(114)115)21-25-117-7)93-68(108)54(29-44-33-80-37-86-44)89-61(102)36-85-72(112)62(40(3)4)97-63(103)41(5)88-66(106)53(28-43-32-83-49-13-9-8-12-47(43)49)94-69(109)55(30-45-34-81-38-87-45)95-70(110)56(31-59(77)100)90-60(101)35-84-65(105)50(14-10-22-82-75(78)79)91-71(111)58-15-11-23-98(58)73(113)57(27-42-16-18-46(99)19-17-42)96-64(104)48(76)20-24-116-6/h8-9,12-13,16-19,32-34,37-41,48,50-58,62,83,99H,10-11,14-15,20-31,35-36,76H2,1-7H3,(H2,77,100)(H,80,86)(H,81,87)(H,84,105)(H,85,112)(H,88,106)(H,89,102)(H,90,101)(H,91,111)(H,92,107)(H,93,108)(H,94,109)(H,95,110)(H,96,104)(H,97,103)(H,114,115)(H4,78,79,82)/t41-,48-,50-,51-,52-,53-,54-,55-,56-,57-,58-,62-/m0/s1",MJHJYGACUDLDMG-QEJDUTAOSA-N,Agonist,Full agonist,,yes,,,pIC50,6.91,,6.83,IC50,148.0,,123.0,=,,,,21729729, BB1 receptor,38,P24053,Rat,gastrin releasing peptide(14-27) (human),6175,,155817491,CSCC[C@H](N)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN=C(N)N)C(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)O)C(C)C,"InChI=1S/C75H109N23O17S2/c1-39(2)26-52(67(107)92-51(74(114)115)21-25-117-7)93-68(108)54(29-44-33-80-37-86-44)89-61(102)36-85-72(112)62(40(3)4)97-63(103)41(5)88-66(106)53(28-43-32-83-49-13-9-8-12-47(43)49)94-69(109)55(30-45-34-81-38-87-45)95-70(110)56(31-59(77)100)90-60(101)35-84-65(105)50(14-10-22-82-75(78)79)91-71(111)58-15-11-23-98(58)73(113)57(27-42-16-18-46(99)19-17-42)96-64(104)48(76)20-24-116-6/h8-9,12-13,16-19,32-34,37-41,48,50-58,62,83,99H,10-11,14-15,20-31,35-36,76H2,1-7H3,(H2,77,100)(H,80,86)(H,81,87)(H,84,105)(H,85,112)(H,88,106)(H,89,102)(H,90,101)(H,91,111)(H,92,107)(H,93,108)(H,94,109)(H,95,110)(H,96,104)(H,97,103)(H,114,115)(H4,78,79,82)/t41-,48-,50-,51-,52-,53-,54-,55-,56-,57-,58-,62-/m0/s1",MJHJYGACUDLDMG-QEJDUTAOSA-N,Agonist,Full agonist,,,,,pIC50,,6.64,,IC50,,230.0,,=,,,,21729729, BB1 receptor,38,P28336,Human,bantag-1,6176,,73755180,CC(C[C@@H](C(=O)NCC1=CCCC(=C1)C[N+](C)(C)C)NC(=O)C[C@@H]([C@@H](NC([C@@H](N(C(=O)[C@H](CC1=CC=CCC1)NC(=O)OC(C)(C)C)C)Cc1c[nH]c[nH+]1)O)CC1CCCCC1)O)C,"InChI=1S/C49H80N8O7/c1-33(2)23-40(45(60)51-29-36-21-16-22-37(24-36)31-57(7,8)9)53-44(59)28-43(58)39(25-34-17-12-10-13-18-34)54-46(61)42(27-38-30-50-32-52-38)56(6)47(62)41(26-35-19-14-11-15-20-35)55-48(63)64-49(3,4)5/h11,14,19,21,24,30,32-34,39-43,46,54,58,61H,10,12-13,15-18,20,22-23,25-29,31H2,1-9H3,(H3-,50,51,52,53,55,59,60,63)/p+2/t39-,40-,41-,42-,43-,46?/m0/s1",DAWSYEXBFLQUER-SLMIJXFKSA-P,Antagonist,Antagonist,,,,,pIC50,5.48,,5.0,IC50,10000.0,,3300.0,=,,,,20096642|23892571,