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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM50506036'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Apelin receptor


(Homo sapiens (Human))		BDBM50506036
PNG
(CHEMBL4443604)
Show SMILES COC[C@H](NC(=O)c1ccc(c(c1)C(O)=O)-c1cc(Cl)ccc1C(=O)Nc1ccc(OC)c(F)c1)c1ccccc1 |r|
Show InChI InChI=1S/C31H26ClFN2O6/c1-40-17-27(18-6-4-3-5-7-18)35-29(36)19-8-11-22(25(14-19)31(38)39)24-15-20(32)9-12-23(24)30(37)34-21-10-13-28(41-2)26(33)16-21/h3-16,27H,17H2,1-2H3,(H,34,37)(H,35,36)(H,38,39)/t27-/m0/s1
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n/an/an/an/a 2.70n/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Agonist activity at human APJ-R expressed in HEK293 cells assessed as inhibition of forskolin- stimulated cAMP accumulation incubated for 30 mins by ...

J Med Chem 62: 10456-10465 (2019)


Article DOI: 10.1021/acs.jmedchem.9b01513
BindingDB Entry DOI: 10.7270/Q2RN3C5X
More data for this
Ligand-Target Pair