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BDBM50296093 3-(9-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-4,4a-dihydro-1H-pyrido[3,4-b]indol-2(3H,9H,9aH)-yl)propanoic acid::CHEMBL557850

SMILES: OC(=O)CCN1CCC2C(C1)N(Cc1cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c1)c1ccccc21

InChI Key: InChIKey=GMXZORXKOQRUQT-XYOKQWHBSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50296093   
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
Cysteinyl leukotriene receptor 1


(GUINEA PIG)		BDBM50296093
PNG
(3-(9-(3-(2-(7-chloroquinolin-2-yl)vinyl)benzyl)-4,...)
Show SMILES OC(=O)CCN1CCC2C(C1)N(Cc1cccc(\C=C\c3ccc4ccc(Cl)cc4n3)c1)c1ccccc21
Show InChI InChI=1S/C32H30ClN3O2/c33-25-11-9-24-10-13-26(34-29(24)19-25)12-8-22-4-3-5-23(18-22)20-36-30-7-2-1-6-27(30)28-14-16-35(21-31(28)36)17-15-32(37)38/h1-13,18-19,28,31H,14-17,20-21H2,(H,37,38)/b12-8+
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Displacement of [3H]LTD4 from CYSLT1 receptor in guinea pig lung membrane

Bioorg Med Chem Lett 19: 4299-302 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.094
BindingDB Entry DOI: 10.7270/Q2CN73Z1
More data for this
Ligand-Target Pair