BDBM50402514 CHEMBL2204088

SMILES: COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccc(NC(=O)NCCc3ccccc3)cc2)cc1

InChI Key: InChIKey=YGZGKSJRWVLLTF-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50402514   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Bone morphogenetic protein 1 (Homo sapiens (Human))	BDBM50402514 (CHEMBL2204088) Show SMILES COc1ccc(CCN(CCC(=O)NO)S(=O)(=O)c2ccc(NC(=O)NCCc3ccccc3)cc2)cc1 Show InChI InChI=1S/C27H32N4O6S/c1-37-24-11-7-22(8-12-24)16-19-31(20-17-26(32)30-34)38(35,36)25-13-9-23(10-14-25)29-27(33)28-18-15-21-5-3-2-4-6-21/h2-14,34H,15-20H2,1H3,(H,30,32)(H2,28,29,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/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