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BDBM50410554 CHEMBL436314

SMILES: Cc1ccc(NC(=O)c2[nH]c(nc2CCC23CC4CC(CC(C4)C2)C3)-c2ccccc2C)cc1C(O)=O

InChI Key: InChIKey=PDKVMFCONNRTTK-UHFFFAOYSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50410554   
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
CCKBR


(RAT)		BDBM50410554
PNG
(CHEMBL436314)
Show SMILES Cc1ccc(NC(=O)c2[nH]c(nc2CCC23CC4CC(CC(C4)C2)C3)-c2ccccc2C)cc1C(O)=O |TLB:18:19:23:17.16.22,22:21:24:17.16.18,22:17:24:21.23.20,THB:18:17:23:19.24.20,20:19:16:21.23.22,20:21:16:19.24.18|
Show InChI InChI=1S/C31H35N3O3/c1-18-5-3-4-6-24(18)28-33-26(9-10-31-15-20-11-21(16-31)13-22(12-20)17-31)27(34-28)29(35)32-23-8-7-19(2)25(14-23)30(36)37/h3-8,14,20-22H,9-13,15-17H2,1-2H3,(H,32,35)(H,33,34)(H,36,37)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/an/a 33.1n/an/an/an/an/a



James Black Foundation

Curated by ChEMBL


Assay Description
Antagonist activity against CCK2 receptor estimated from single shifts of pentagastrin concentration-effect curves in the isolated rat stomach

J Med Chem 48: 6803-12 (2005)


Article DOI: 10.1021/jm0490686
BindingDB Entry DOI: 10.7270/Q2PV6MM7
More data for this
Ligand-Target Pair