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SMILES: COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccccc2S(C)(=O)=O)cc1

InChI Key: InChIKey=CZAPPXSCRRMUPJ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50402528   
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))		BDBM50402528
PNG
(CHEMBL2204808)
Show SMILES COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccccc2S(C)(=O)=O)cc1
Show InChI InChI=1S/C19H24N2O7S2/c1-28-16-9-7-15(8-10-16)11-13-21(14-12-19(22)20-23)30(26,27)18-6-4-3-5-17(18)29(2,24)25/h3-10,23H,11-14H2,1-2H3,(H,20,22)
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PubMed
n/an/a 9.10E+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