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SMILES: COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccccc2C(=N)NO)cc1

InChI Key: InChIKey=KXAXKPJNJJMWPL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50402531   
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
Bone morphogenetic protein 1


(Homo sapiens (Human))		BDBM50402531
PNG
(CHEMBL2204804)
Show SMILES COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccccc2C(=N)NO)cc1
Show InChI InChI=1S/C19H24N4O6S/c1-29-15-8-6-14(7-9-15)10-12-23(13-11-18(24)21-25)30(27,28)17-5-3-2-4-16(17)19(20)22-26/h2-9,25-26H,10-13H2,1H3,(H2,20,22)(H,21,24)
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Article
PubMed
n/an/a 7.10E+3n/an/an/an/an/an/a



FibroGen Inc.

Curated by ChEMBL


Assay Description
Inhibition of PCP after 1 hr by fluorescence assay

Bioorg Med Chem Lett 22: 7397-401 (2012)


Article DOI: 10.1016/j.bmcl.2012.10.067
BindingDB Entry DOI: 10.7270/Q22808SM
More data for this
Ligand-Target Pair