amanitin   Click here for help

GtoPdb Ligand ID: 4632

Synonyms: α-amanitin
Compound class: Peptide or derivative
Comment: From Amanita phalloides (Death cap)
2D Structure
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2D Structure

An image of the ligand's 2D structure. For small molecules with SMILES these are drawn using the NCI/CADD Chemical Identifier Resolver. Click on the image to access the chemical structure search tool with the ligand pre-loaded in the structure editor. For other types of ligands, e.g. longer nucleotides and peptides, a manually drawn representation of the molecule may be provided.

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SMILES / InChI / InChIKey
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SMILES / InChI / InChIKey

SMILES (Simplified Molecular Input Line Entry Specification) A specification for unambiguously describing the structure of chemical molecules using short ASCII strings. Canonical SMILES specify a unique representation of the 2D structure without chiral or isotopic specifications. Isomeric SMILES include chiral specification and isotopes.

Standard InChI (IUPAC International Chemical Identifier) and InChIKey InChI is a non-proprietary, standard, textual identifier for chemical substances designed to facilitate linking of information and database searching. An InChIKey is a simplified version of a full InChI, designed for easier web searching.

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Canonical SMILES OCC(C(C1NC(=O)C2CC(CN2C(=O)C(CC(=O)N)NC(=O)C2CS(=O)c3c(CC(NC1=O)C(=O)NCC(=O)NC(C(CC)C)C(=O)NCC(=O)N2)c1ccc(cc1[nH]3)O)O)C)O
Isomeric SMILES OC[C@@H](C([C@@H]1NC(=O)[C@@H]2CC(CN2C(=O)[C@H](CC(=O)N)NC(=O)[C@@H]2CS(=O)c3c(C[C@H](NC1=O)C(=O)NCC(=O)N[C@@H](C(CC)C)C(=O)NCC(=O)N2)c1ccc(cc1[nH]3)O)O)C)O
InChI InChI=1S/C39H54N10O14S/c1-4-16(2)31-36(60)42-11-29(55)43-25-15-64(63)38-21(20-6-5-18(51)7-22(20)46-38)9-23(33(57)41-12-30(56)47-31)44-37(61)32(17(3)27(53)14-50)48-35(59)26-8-19(52)13-49(26)39(62)24(10-28(40)54)45-34(25)58/h5-7,16-17,19,23-27,31-32,46,50-53H,4,8-15H2,1-3H3,(H2,40,54)(H,41,57)(H,42,60)(H,43,55)(H,44,61)(H,45,58)(H,47,56)(H,48,59)/t16?,17?,19?,23-,24-,25-,26-,27-,31-,32-,64?/m0/s1
InChI Key CIORWBWIBBPXCG-JZTFPUPKSA-N

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Structurally Similar Ligands Click here for help
BJP-06-005-3

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daptomycin

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CD36 molecule 		Click here for ligand page
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CD36 molecule 		Click here for ligand page
GPR15L (71-81)

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GPR15 		Click here for ligand page
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GPR15 		Click here for ligand page
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GPR55 		Click here for ligand page
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GPR55 		Click here for ligand page
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GPR55 		Click here for ligand page
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MC1 receptor; MC3 receptor; MC4 receptor; MC5 receptor 		Click here for ligand page
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null 		Click here for ligand page
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C3a receptor 		Click here for ligand page
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kisspeptin receptor 		Click here for ligand page
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GLP-1 receptor 		Click here for ligand page
[Orn5]URP

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UT receptor 		Click here for ligand page
deslorelin

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GnRH1 receptor 		Click here for ligand page
alarelin

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GnRH1 receptor 		Click here for ligand page
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GnRH1 receptor 		Click here for ligand page
setmelanotide

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MC1 receptor; MC3 receptor; MC4 receptor; MC5 receptor 		Click here for ligand page
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null 		Click here for ligand page
bihelical apoA-I mimetic peptide 5A

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ABCA1 		Click here for ligand page
compound 5d [PMID: 25815150]

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NMU1 receptor 		Click here for ligand page
human GIP(5-30)NH2

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GIP receptor 		Click here for ligand page
human GIP(3-30)NH2

Targets
GIP receptor 		Click here for ligand page
polybia-MP1

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hK2p01 derivative KLK2 inhibitor

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kallikrein related peptidase 2 		Click here for ligand page
veldoreotide

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SST2 receptor; SST4 receptor; SST5 receptor 		Click here for ligand page
gastrin-14

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CCK2 receptor 		Click here for ligand page
desulfated gastrin-34

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CCK2 receptor 		Click here for ligand page
desulfated gastrin-17

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CCK2 receptor 		Click here for ligand page
SQ007-5

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C3a receptor 		Click here for ligand page
lisinopril-tryptophan

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Angiotensin-converting enzyme 		Click here for ligand page
ilomastat

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ADAM10; ADAM12; ADAM17; ADAM9; MMP1; MMP12; MMP14; MMP15; MMP16; MMP17; MMP2; MMP26; MMP9 		Click here for ligand page
lixisenatide

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GLP-1 receptor 		Click here for ligand page
CGEN-857

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MAS1 		Click here for ligand page
cosyntropin

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MC2 receptor 		Click here for ligand page
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AT2 receptor 		Click here for ligand page
eptifibatide

Targets
integrin αIIbβ3 		Click here for ligand page
GLP-1-(9-36)

Targets
GLP-1 receptor 		Click here for ligand page
SHAAGtide

Targets
FPR2/ALX 		Click here for ligand page
F peptide

Targets
FPR2/ALX 		Click here for ligand page
N36

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FPR2/ALX 		Click here for ligand page
phenylacetyl-Ala,DTrp-phenthylamide

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BB3 receptor 		Click here for ligand page
[D-Tpi6, Leu13 ψ(CH2NH)-Leu14]bombesin-(6-14)

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BB2 receptor 		Click here for ligand page
gastrin releasing peptide(14-27) (human)

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BB1 receptor; BB2 receptor 		Click here for ligand page
[Leu8]-phyllolitorin

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BB1 receptor; BB2 receptor 		Click here for ligand page
phyllolitorin

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BB1 receptor; BB2 receptor 		Click here for ligand page
Rhodei-litorin

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BB1 receptor; BB2 receptor 		Click here for ligand page
galanin(2-29) (pig)

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GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
galanin

Targets
GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
GALP(3-32) (human)

Targets
GAL1 receptor; GAL2 receptor 		Click here for ligand page
GALP(1-32) (human)

Targets
GAL1 receptor; GAL2 receptor 		Click here for ligand page
[125I][Tyr26]galanin (pig)

Targets
GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
galanin(2-30) (human)

Targets
GAL1 receptor; GAL2 receptor 		Click here for ligand page
galanin(1-19) (human)

Targets
GAL1 receptor 		Click here for ligand page
galanin(1-16) (rat/mouse/pig)

Targets
GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
galanin(1-15)

Targets
GAL1 receptor; GAL2 receptor 		Click here for ligand page
galanin(1-11)

Targets
GAL1 receptor; GAL2 receptor 		Click here for ligand page
gG-2p20

Targets
FPR1 		Click here for ligand page
Met-Met-Trp-Leu-Leu

Targets
FPR1 		Click here for ligand page
WWGKKYRASKLGLAR

Targets
C3a receptor 		Click here for ligand page
[125I][Tyr26]galanin (human)

Targets
GAL1 receptor; GAL2 receptor 		Click here for ligand page
[125I][Tyr26]galanin (rat/mouse)

Targets
GAL1 receptor 		Click here for ligand page
galanin(2-11)

Targets
GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
galanin-(1-11)

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LVV-hemorphin

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glucagon-like peptide 1

Targets
dipeptidyl peptidase 4 		Click here for ligand page
phalloidin

Targets
OATP1B3 		Click here for ligand page
PTH-(1-34) (rat)

Targets
PTH1 receptor; PTH2 receptor 		Click here for ligand page
teriparatide

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PTH1 receptor; PTH2 receptor 		Click here for ligand page
psalmotoxin 1

Targets
ASIC1 		Click here for ligand page
iberiotoxin

Targets
KCa1.1 		Click here for ligand page
[125I]psalmotoxin 1

Targets
ASIC1 		Click here for ligand page
bovine adrenal medulla peptide 8-22

Targets
MRGPRX1 		Click here for ligand page
[125I]PrRP31

Targets
PrRP receptor 		Click here for ligand page
[3H]EYF

Targets
NPFF2 receptor 		Click here for ligand page
[125I]kisspeptin-14 (human)

Targets
kisspeptin receptor 		Click here for ligand page
E7

Targets
C3a receptor 		Click here for ligand page
TAK 044

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ETA receptor; ETB receptor 		Click here for ligand page
MEN10627

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NK2 receptor 		Click here for ligand page
IRL 1620

Targets
ETB receptor 		Click here for ligand page
histrelin

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GnRH1 receptor 		Click here for ligand page
GR94800

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NK2 receptor 		Click here for ligand page
GR100679

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NK2 receptor 		Click here for ligand page
goserelin

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GnRH1 receptor 		Click here for ligand page
galanin(2-29) (rat/mouse)

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GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
[D-Trp2]galanin-(1-29)

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GAL2 receptor 		Click here for ligand page
C7

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GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
buserelin

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GnRH1 receptor 		Click here for ligand page
BQ 3020

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ETB receptor 		Click here for ligand page
[3H]MCH (human, mouse, rat)

Targets
MCH1 receptor 		Click here for ligand page
[125I]kisspeptin-13 (human)

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kisspeptin receptor 		Click here for ligand page
[125I]GRP (human)

Targets
BB2 receptor 		Click here for ligand page
[125I]GnRH II (human)

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[125I]GnRH I (human, mouse, rat)

Targets
GnRH1 receptor 		Click here for ligand page
[125I]glucagon (human, mouse, rat)

Targets
glucagon receptor 		Click here for ligand page
[125I]GLP-1-(7-37) (human)

Targets
GLP-1 receptor 		Click here for ligand page
[125I]BH-NMB (human, mouse, rat)

Targets
BB1 receptor 		Click here for ligand page
[125I]ACTH-(1-24)

Targets
MC2 receptor 		Click here for ligand page
[125I][Ala1,3,11,15]ET-1

Targets
ETB receptor 		Click here for ligand page
neuropeptide AF

Targets
NPFF1 receptor; NPFF2 receptor 		Click here for ligand page
exendin-3

Targets
GLP-1 receptor 		Click here for ligand page
desulfated cholecystokinin-8

Targets
CCK1 receptor; CCK2 receptor 		Click here for ligand page
PTHrP-(107-139)

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PTH1 receptor; PTH2 receptor 		Click here for ligand page
PTHrP-(107-139)

Targets
PTH1 receptor; PTH2 receptor 		Click here for ligand page
PTHrP-(107-139)

Targets
PTH1 receptor; PTH2 receptor 		Click here for ligand page
big dynorphin

Targets
κ receptor 		Click here for ligand page
ACTH

Targets
MC1 receptor; MC2 receptor; MC3 receptor; MC4 receptor; MC5 receptor 		Click here for ligand page
galanin

Targets
GAL1 receptor; GAL2 receptor; GAL3 receptor 		Click here for ligand page
apelin-36

Targets
apelin receptor 		Click here for ligand page
glucagon-like peptide 1-(7-37)

Targets
GLP-1 receptor 		Click here for ligand page
glucagon-like peptide 2-(3-33)

Targets
GLP-2 receptor 		Click here for ligand page
glucagon-like peptide 2

Targets
GLP-2 receptor 		Click here for ligand page
MEN 10376

Targets
NK2 receptor 		Click here for ligand page
[125I]tertiapin Y1/K12/Q13

Targets
Kir1.1 		Click here for ligand page
slotoxin

Targets
KCa1.1 		Click here for ligand page
urotensin II-related peptide

Targets
UT receptor 		Click here for ligand page
U-II-(4-11) (human)

Targets
UT receptor 		Click here for ligand page
nepadutant

Targets
NK2 receptor 		Click here for ligand page
R396

Targets
NK2 receptor 		Click here for ligand page
FK-888

Targets
NK1 receptor; NK2 receptor 		Click here for ligand page
spantide II

Targets
NK1 receptor 		Click here for ligand page
BIM 23268

Targets
SST5 receptor 		Click here for ligand page
octreotide

Targets
SST2 receptor; SST3 receptor; SST5 receptor 		Click here for ligand page
seglitide

Targets
SST2 receptor; SST3 receptor; SST5 receptor 		Click here for ligand page
lanreotide

Targets
SST2 receptor; SST3 receptor; SST5 receptor 		Click here for ligand page
SRIF-28

Targets
SST1 receptor; SST2 receptor; SST3 receptor; SST4 receptor; SST5 receptor 		Click here for ligand page
SRIF-14

Targets
SST1 receptor; SST2 receptor; SST3 receptor; SST4 receptor; SST5 receptor 		Click here for ligand page
pasireotide

Targets
SST1 receptor; SST2 receptor; SST3 receptor; SST5 receptor 		Click here for ligand page
CGP 23996

Targets
SST1 receptor; SST2 receptor; SST3 receptor; SST4 receptor; SST5 receptor 		Click here for ligand page
[125I]PrRP-20 (human)

Targets
PrRP receptor 		Click here for ligand page
TIP39-(7-39) (mouse)

Targets
PTH2 receptor 		Click here for ligand page
TIP39-(7-39) (human/bovine)

Targets
PTH1 receptor; PTH2 receptor 		Click here for ligand page
TIP39-(9-39) (human/bovine)

Targets
PTH1 receptor 		Click here for ligand page
TIP39-(3-39) (human/bovine)

Targets
PTH1 receptor 		Click here for ligand page
PTHrP-(1-21)/PTH-(22-34) (human)

Targets
PTH1 receptor; PTH2 receptor 		Click here for ligand page
PTHrP-(1-20)/TIP-(23-39) (human)

Targets
PTH1 receptor 		Click here for ligand page
CTOP

Targets
μ receptor 		Click here for ligand page
CTAP

Targets
δ receptor; μ receptor 		Click here for ligand page
endomorphin-1

Targets
δ receptor; μ receptor 		Click here for ligand page
dynorphin A

Targets
δ receptor; κ receptor; μ receptor 		Click here for ligand page
xenin

Targets
NTS2 receptor 		No image available
JMV458

Targets
NTS1 receptor; NTS2 receptor 		No image available
EISAI-1

Targets
NTS1 receptor 		No image available
[125I]NPW-23 (human)

Targets
NPBW1 receptor; NPBW2 receptor 		No image available
[125I]EYF

Targets
NPFF2 receptor 		No image available
ACTH-(1-24)

Targets
MC2 receptor 		No image available
afamelanotide

Targets
MC1 receptor; MC3 receptor; MC4 receptor; MC5 receptor 		No image available
MT-II

Targets
MC1 receptor; MC3 receptor; MC4 receptor; MC5 receptor 		No image available
variant MCH

Targets
MCH1 receptor 		No image available
MCH (salmon)

Targets
MCH1 receptor; MCH2 receptor 		No image available
melanin-concentrating hormone

Targets
MCH1 receptor; MCH2 receptor 		No image available
S36077

Targets
MCH1 receptor 		No image available
MCH6-17

Targets
MCH1 receptor 		No image available
kisspeptin-15

Targets
kisspeptin receptor 		No image available
kisspeptin-10

Targets
kisspeptin receptor 		No image available
[125I]kisspeptin-10 (human)

Targets
kisspeptin receptor 		No image available
[125I]Tyr45-kisspeptin-15

Targets
kisspeptin receptor 		No image available
triptorelin

Targets
GnRH1 receptor 		No image available
leuprolide

Targets
GnRH1 receptor 		No image available
[Trp8]GnRH

Targets
GnRH1 receptor 		No image available
[Ser8]GnRH

Targets
GnRH1 receptor 		No image available
[Gln8]GnRH

Targets
GnRH1 receptor 		No image available
GnRH I

Targets
GnRH1 receptor; GnRH2 receptor 		No image available
[Tyr34]GLP-2 (human)

Targets
GLP-2 receptor 		No image available
glucagon-like peptide 2-(3-33)

Targets
GLP-2 receptor 		No image available
glucagon-like peptide 2-(3-33)

Targets
GLP-2 receptor 		No image available
glucagon-like peptide 2-(2-33)

Targets
GLP-2 receptor 		No image available
glucagon-like peptide 2

Targets
GLP-2 receptor 		No image available
glucagon-like peptide 2

Targets
GLP-2 receptor 		No image available
GLP-2-(1-29) (rat)

Targets
GLP-2 receptor 		No image available
exendin-(9-39)

Targets
GLP-1 receptor 		No image available
[125I]exendin-(9-39)

Targets
GLP-1 receptor 		No image available
glucagon

Targets
GLP-1 receptor; glucagon receptor 		No image available
[125I]GLP-1-(7-36)-amide

Targets
GLP-1 receptor 		No image available
liraglutide

Targets
GLP-1 receptor 		No image available
GIP-(6-30)-amide

Targets
GIP receptor 		No image available
GIP-(10-30)

Targets
GIP receptor 		No image available
[125I]Tyr-Ala-hexarelin

Targets
ghrelin receptor 		No image available
GHRP-6

Targets
ghrelin receptor 		No image available
pralmorelin

Targets
ghrelin receptor 		No image available
spinorphin

Targets
FPR1; P2X3 		No image available
[125I]IRL1620

Targets
ETB receptor 		No image available
[3H]BQ123

Targets
ETA receptor 		No image available
[125I]PD151242

Targets
ETA receptor 		No image available
FR139317

Targets
ETA receptor 		No image available
BQ123

Targets
ETA receptor; OATP3A1 		No image available
sarafotoxin S6b

Targets
ETA receptor 		No image available
[125I]ET-2 (human)

Targets
ETA receptor 		No image available
[125I]ET-1 (human, mouse, rat)

Targets
ETA receptor; ETB receptor 		No image available
endothelin-2

Targets
ETA receptor; ETB receptor; Endothelin-converting enzyme 1; Endothelin-converting enzyme 2 		No image available
endothelin-1

Targets
ETA receptor; ETB receptor; Endothelin-converting enzyme 1; Endothelin-converting enzyme 2 		No image available
RB-400

Targets
CCK2 receptor 		No image available
BC-264

Targets
CCK2 receptor 		No image available
pentagastrin

Targets
CCK1 receptor; CCK2 receptor 		No image available
CCK-4

Targets
CCK1 receptor; CCK2 receptor 		No image available
CCK-33

Targets
CCK1 receptor; CCK2 receptor 		No image available
A-71623

Targets
CCK1 receptor 		No image available
T22

Targets
CXCR4 		No image available
T134

Targets
CXCR4 		No image available
ranatensin

Targets
BB1 receptor; BB2 receptor 		No image available
bombesin

Targets
BB1 receptor; BB2 receptor 		No image available
neuromedin B

Targets
BB1 receptor; BB2 receptor 		No image available
apelin-36

Targets
apelin receptor 		No image available
PMX53

Targets
C5a1 receptor 		No image available