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BDBM50061712 CHEMBL3394206

SMILES: COc1ccc(CC(=O)N2CCC3(CN(C3)[C@@H]3CCc4cc(ccc34)-c3cc(C)ncn3)CC2)c(NC(C)=O)c1

InChI Key: InChIKey=HHYDZKYZQXBCPD-SSEXGKCCSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50061712   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ghrelin receptor


(Homo sapiens (Human))
BDBM50061712
PNG
(CHEMBL3394206)
Show SMILES COc1ccc(CC(=O)N2CCC3(CN(C3)[C@@H]3CCc4cc(ccc34)-c3cc(C)ncn3)CC2)c(NC(C)=O)c1
Show InChI InChI=1S/C32H37N5O3/c1-21-14-28(34-20-33-21)24-5-8-27-23(15-24)6-9-30(27)37-18-32(19-37)10-12-36(13-11-32)31(39)16-25-4-7-26(40-3)17-29(25)35-22(2)38/h4-5,7-8,14-15,17,20,30H,6,9-13,16,18-19H2,1-3H3,(H,35,38)/t30-/m1/s1
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PC cid
PC sid
UniChem

Similars

Article
PubMed
28n/an/an/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]Ghrelin from human GHS-R1a expressed in HEK293 cells after 8 hrs by SPA method


ACS Med Chem Lett 6: 156-61 (2015)


Article DOI: 10.1021/ml500414n
BindingDB Entry DOI: 10.7270/Q2N58P10
More data for this
Ligand-Target Pair