substance P [Ligand Id: 2098] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL235363 (Substance p)
  • NK1 receptor/Neurokinin 1 receptor in Human [ChEMBL: CHEMBL249] [GtoPdb: 360] [UniProtKB: P25103]
  • NK1 receptor/Neurokinin 1 receptor in Rat [ChEMBL: CHEMBL4027] [GtoPdb: 360] [UniProtKB: P14600]
  • Neurokinin 1 receptor in Guinea pig [ChEMBL: CHEMBL3942] [UniProtKB: P30547]
  • 7.3
1 CHEMBL235363_lig_chart_1 Neurokinin 1 receptor HumanRatGuinea pig
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2 CHEMBL235363_lig_chart_2 Neurokinin 2 receptor HumanHamsterRat
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  • NK3 receptor/Neurokinin 3 receptor in Human [ChEMBL: CHEMBL4429] [GtoPdb: 362] [UniProtKB: P29371]
  • NK3 receptor in Mouse [GtoPdb: 362] [UniProtKB: P47937]
  • NK3 receptor/Neurokinin 3 receptor in Rat [ChEMBL: CHEMBL3154] [GtoPdb: 362] [UniProtKB: P16177]
  • Neurokinin 3 receptor in Guinea pig [ChEMBL: CHEMBL3799] [UniProtKB: P30098]
  • 0
3 CHEMBL235363_lig_chart_3 Neurokinin 3 receptor HumanMouseRatGuinea pig
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  • MRGPRX2 in Human [GtoPdb: 157] [UniProtKB: Q96LB1]
  • This target only has 0 pki data point
  • 0
4 CHEMBL235363_lig_chart_4 MRGPRX2 Human
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
NK1 receptor/Neurokinin 1 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL249] [GtoPdb: 360] [UniProtKB: P25103]
ChEMBL Compound was evaluated for affinity towards human tachykinin NK-1 receptor expressed in CHO cells B 8.8 pKi 1.6 nM Ki Bioorg. Med. Chem. Lett. (1998) 8: 1369-1374 [PMID:9871768]
GtoPdb - - 10.3 pKi - - - Br J Pharmacol (2002) 135: 266-74 [PMID:11786503];
Bioorg Med Chem (2004) 12: 4533-41 [PMID:15265501]
ChEMBL Tested for binding affinity against Q165A mutant NK1 receptor expressed in CHO cells, using [125]SP as radioligand B 8.77 pIC50 1.7 nM IC50 J. Med. Chem. (2000) 43: 3827-3831 [PMID:11052787]
ChEMBL Displacement of [125I]BH-SP to human recombinant NK1 receptor in CHO cells B 8.82 pIC50 1.5 nM IC50 Bioorg. Med. Chem. (2008) 16: 6850-6859 [PMID:18554914]
ChEMBL Displacement of [125I]BH-SP from human recombinant NK1 receptor expressed in CHO cells after 90 mins B 8.82 pIC50 1.5 nM IC50 Bioorg. Med. Chem. (2011) 19: 2242-2251 [PMID:21421318]
ChEMBL Tested for binding affinity against human wild type NK1 receptor expressed in CHO cells, using [125]SP as radioligand. B 8.85 pIC50 1.4 nM IC50 J. Med. Chem. (2000) 43: 3827-3831 [PMID:11052787]
ChEMBL Tested for binding affinity against H265A mutant NK1 receptor using [125]SP radioligand in COS cells. B 8.96 pIC50 1.1 nM IC50 J. Med. Chem. (2000) 43: 3827-3831 [PMID:11052787]
ChEMBL Tested for binding affinity against H197A mutant NK1 receptor using [125]SP radioligand in COS cells. B 9.05 pIC50 0.9 nM IC50 J. Med. Chem. (2000) 43: 3827-3831 [PMID:11052787]
ChEMBL Antagonist activity for Tachykinin receptor 1 as displacement of [3H]-Substance P in human IM-9 cells F 9.21 pIC50 0.61 nM IC50 Bioorg. Med. Chem. Lett. (1998) 8: 281-284 [PMID:9871670]
ChEMBL Inhibitory activity against binding of [125I]Bolton-Hunter SP to tachykinin NK-1 receptor in human lymphoma IM9 cells. B 9.59 pIC50 0.26 nM IC50 Bioorg. Med. Chem. Lett. (1996) 6: 165-166
ChEMBL Compound was evaluated for the antagonistic activity against NK1 receptor F 9.62 pIC50 0.24 nM IC50 Bioorg. Med. Chem. Lett. (1997) 7: 2819-2824
ChEMBL Binding affinity against human Tachykinin receptor 1 expressed in astrocytoma UC11MG cells using [125I]- SP radioligand B 9.92 pIC50 0.12 nM IC50 J. Med. Chem. (2004) 47: 1315-1318 [PMID:14998319]
ChEMBL Agonist activity at bfSPR to produce increase in intracellular [Ca2+] F 9 pEC50 1 nM EC50 J. Med. Chem. (2000) 43: 1741-1753 [PMID:10794691]
ChEMBL SP-induced [Ca2+] mobilization in CHO cells expressing human Tachykinin receptor 1 B 9.22 pEC50 0.6 nM EC50 J. Med. Chem. (2000) 43: 1741-1753 [PMID:10794691]
ChEMBL Agonist activity at wild type human NK1 receptor expressed in HEK293 cells assessed as increase in [3H]IP accumulation after 20 mins F 9.22 pEC50 0.6 nM EC50 J. Med. Chem. (2012) 55: 5061-5076 [PMID:22574973]
ChEMBL Antagonist activity at human recombinant NK1 receptor expressed in CHO cells assessed as inhibition of NPS-induced intracellular calcium mobilization F 10.24 pEC50 0.06 nM EC50 J. Med. Chem. (2009) 52: 4068-4071 [PMID:19473027]
NK1 receptor/Neurokinin 1 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4027] [GtoPdb: 360] [UniProtKB: P14600]
ChEMBL Ability to inhibit the binding of [125I]physalaemin to the SP receptors in rat telencephalon slices B 8.96 pKi 1.1 nM Ki J. Med. Chem. (1987) 30: 1529-1532 [PMID:2441057]
ChEMBL Affinity for rat Tachykinin receptor 1 determined in displacement screening by using radioligand 3,4-[3H]-(L-Pro e2) SP. B 8.82 pIC50 1.5 nM IC50 J. Med. Chem. (1999) 42: 4331-4342 [PMID:10543877]
ChEMBL Displacement of [Leu-3,4,5-3H(N)]-Substance P from NK1 receptor in rat brain homogenate measured after 60 mins by microbeta scintillation counting analysis B 8.96 pIC50 1.09 nM IC50 ACS Med Chem Lett (2017) 8: 73-77 [PMID:28105278]
ChEMBL Concentration required to inhibit the specific binding of [125I]BH-SP to Neurokinin-1 (NK-1) receptor in rat brain synaptosomes B 9.19 pIC50 0.64 nM IC50 J. Med. Chem. (1994) 37: 1586-1601 [PMID:7515443]
ChEMBL Displacement of [125I]Lys3-substance P from rat NK1 receptor expressed in CHO cells B 9.39 pIC50 0.41 nM IC50 J. Med. Chem. (2007) 50: 6501-6506 [PMID:18067242]
ChEMBL Tested for inhibition of tachykinin 1 (NK1) receptor in rat brain synaptosomal membranes using [125I]BH-SP as radioligand B 9.43 pIC50 0.37 nM IC50 Bioorg. Med. Chem. Lett. (1993) 3: 447-450
ChEMBL Binding affinity for tachykinin receptor 1 from rat forebrain tissue, [125I]-BH-SP as radioligand B 9.92 pIC50 0.12 nM IC50 J. Med. Chem. (1991) 34: 1751-1753 [PMID:1851847]
ChEMBL Binding affinity towards Tachykinin receptor 1 in rat cerebral cortex membranes was determined by using 125 [I]-BHSP as radioligand B 9.92 pIC50 0.12 nM IC50 Bioorg. Med. Chem. Lett. (1992) 2: 559-564
ChEMBL Inhibition of Tachykinin receptor 1 of rat forebrain tissue B 9.92 pIC50 0.12 nM IC50 J. Med. Chem. (1992) 35: 1273-1279 [PMID:1373191]
ChEMBL Inhibition of [125]I-Bolton Hunter Substance P([125]I-BHSP) binding to standard Tachykinin receptor 1 from rat forebrain membranes. B 9.92 pIC50 0.12 nM IC50 J. Med. Chem. (1992) 35: 374-378 [PMID:1370695]
Neurokinin 1 receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3942] [UniProtKB: P30547]
ChEMBL Evaluated for the binding affinity against NK1 receptor B 7.3 pKi 50.5 nM Ki J. Med. Chem. (1993) 36: 3197-3201 [PMID:7693945]
ChEMBL Binding affinity towards Tachykinin receptor 1 binding in guinea pig cerebral cortex membranes was determined using [3H]SP as the radioligand B 10.15 pIC50 0.07 nM IC50 Bioorg. Med. Chem. Lett. (1992) 2: 559-564
ChEMBL In vitro agonistic activity against tachykinin receptor 1 of guinea pig ileum longitudinal smooth muscle. F 8.25 pEC50 5.6 nM EC50 J. Med. Chem. (1992) 35: 4195-4204 [PMID:1331460]
ChEMBL Agonistic activity at neurokinin-1 (NK-1) receptor in guinea pig ileum longitudinal smooth muscle F 8.31 pEC50 4.91 nM EC50 J. Med. Chem. (1990) 33: 1848-1851 [PMID:1694545]
ChEMBL Agonistic activity at tachykinin receptor 1 receptor in guinea pig ileum longitudinal smooth muscle F 9 pEC50 1 nM EC50 J. Med. Chem. (1990) 33: 1848-1851 [PMID:1694545]
NK2 receptor/Neurokinin 2 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2327] [GtoPdb: 361] [UniProtKB: P21452]
GtoPdb - - 6.9 pKi - - - Br J Pharmacol (2002) 135: 266-74 [PMID:11786503];
J Pharmacol Exp Ther (1997) 281: 1303-11 [PMID:9190866];
Biochem Biophys Res Commun (1993) 191: 1172-7 [PMID:7682062]
ChEMBL The compound was tested for competition binding with [3H]NKA against the CHO cells from cloned human Tachykinin receptor 2 B 6.99 pKi 102 nM Ki J. Med. Chem. (1999) 42: 3004-3007 [PMID:10425111]
ChEMBL Inhibitory activity against human Tachykinin receptor 2 B 6.61 pIC50 245.47 nM IC50 J. Med. Chem. (1999) 42: 3004-3007 [PMID:10425111]
Neurokinin 2 receptor in Hamster (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2304405] [UniProtKB: P51144]
ChEMBL Competitive inhibition of [125I]NKA binding to hamster urinary bladder Tachykinin receptor 2 B 6.83 pIC50 148 nM IC50 J. Med. Chem. (1992) 35: 3949-3955 [PMID:1331450]
NK2 receptor/Neurokinin 2 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4554] [GtoPdb: 361] [UniProtKB: P16610]
ChEMBL Concentration required to inhibit the specific binding of [125I]NKA to Neurokinin-2 (NK-2) receptor in rat duodenum membranes B 6.7 pIC50 200 nM IC50 J. Med. Chem. (1994) 37: 1586-1601 [PMID:7515443]
ChEMBL Agonist activity was measured at neurokinin-2 receptor in the rat colon muscularis mucosae F 6.78 pEC50 167.4 nM EC50 J. Med. Chem. (1990) 33: 1848-1851 [PMID:1694545]
ChEMBL In vitro agonistic activity against tachykinin receptor 2 of rat colon muscularis mucosae. F 6.78 pEC50 167 nM EC50 J. Med. Chem. (1992) 35: 4195-4204 [PMID:1331460]
ChEMBL Agonist activity at tachykinin receptor 2 in the rat colon muscularis mucosae F 9 pEC50 1 nM EC50 J. Med. Chem. (1990) 33: 1848-1851 [PMID:1694545]
NK3 receptor/Neurokinin 3 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4429] [GtoPdb: 362] [UniProtKB: P29371]
GtoPdb - - 6 pKi - - - J Pharmacol Exp Ther (1997) 281: 1303-11 [PMID:9190866];
Eur J Pharmacol (2001) 413: 143-50 [PMID:11226387]
ChEMBL Compound was evaluated for its ability to displace [3H]NKB binding in hNK3 receptors expressed in CHO cells B 6.9 pIC50 125 nM IC50 Bioorg. Med. Chem. Lett. (1998) 8: 1343-1348 [PMID:9871763]
ChEMBL Compound was evaluated for concentration-dependent and oscillatory increase in [Ca2+], caused by activation of hNK3 receptors in CHO cells F 6.1 pEC50 793 nM EC50 Bioorg. Med. Chem. Lett. (1998) 8: 1343-1348 [PMID:9871763]
NK3 receptor in Mouse [GtoPdb: 362] [UniProtKB: P47937]
GtoPdb - - 5.3 pKi - - - Eur J Pharmacol (2001) 413: 143-50 [PMID:11226387]
NK3 receptor/Neurokinin 3 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3154] [GtoPdb: 362] [UniProtKB: P16177]
ChEMBL Concentration required to inhibit the specific binding of [125I]BH-ELE to Neurokinin-3 (NK-3) receptor in rat brain synaptosomes B 6.89 pIC50 130 nM IC50 J. Med. Chem. (1994) 37: 1586-1601 [PMID:7515443]
ChEMBL In vitro agonistic activity against tachykinin receptor 3 of everted rat protal vein. F 5.12 pEC50 7500 nM EC50 J. Med. Chem. (1992) 35: 4195-4204 [PMID:1331460]
Neurokinin 3 receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3799] [UniProtKB: P30098]
ChEMBL Inhibitory activity against binding of [125I][MePhe7]-NKB SP to tachykinin NK-3 receptor in guinea pig cortical membranes. B 6.14 pIC50 717 nM IC50 Bioorg. Med. Chem. Lett. (1996) 6: 165-166
MRGPRX2 in Human [GtoPdb: 157] [UniProtKB: Q96LB1]
GtoPdb In a calcium mobilisation asay. - 5.97 pEC50 1071 nM EC50 Nat Chem Biol (2017) 13: 529-536 [PMID:28288109];
Nature (2015) 519: 237-41 [PMID:25517090]

ChEMBL data shown on this page come from version 28:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, Cibrián-Uhalte E, Davies M, Dedman N, Karlsson A, Magariños MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]