BDBM50336578 3-(biphenyl-4-yloxy)-8-oxo-8H-acenaphtho[1,2-b]pyrrole-9-carbonitrile::CHEMBL1672069

SMILES: O=c1nc2c3cccc4c(Oc5ccc(cc5)-c5ccccc5)ccc(c2c1C#N)c34

InChI Key: InChIKey=BRYQRJBYNBYHAH-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 50336578   

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
Apoptosis regulator Bcl-2 (Homo sapiens (Human))	BDBM50336578 (3-(biphenyl-4-yloxy)-8-oxo-8H-acenaphtho[1,2-b]pyr...) Show SMILES O=c1nc2c3cccc4c(Oc5ccc(cc5)-c5ccccc5)ccc(c2c1C#N)c34 Show InChI InChI=1S/C27H14N2O2/c28-15-22-25-20-13-14-23(19-7-4-8-21(24(19)20)26(25)29-27(22)30)31-18-11-9-17(10-12-18)16-5-2-1-3-6-16/h1-14H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	278	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Displacement of FAM-Bid peptide from human recombinant Bcl2 after 30 mins by by competitive fluorescence polarization assay				Eur J Med Chem 46: 3909-16 (2011) Article DOI: 10.1016/j.ejmech.2011.05.062 BindingDB Entry DOI: 10.7270/Q2MK6D8W
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50336578 (3-(biphenyl-4-yloxy)-8-oxo-8H-acenaphtho[1,2-b]pyr...) Show SMILES O=c1nc2c3cccc4c(Oc5ccc(cc5)-c5ccccc5)ccc(c2c1C#N)c34 Show InChI InChI=1S/C27H14N2O2/c28-15-22-25-20-13-14-23(19-7-4-8-21(24(19)20)26(25)29-27(22)30)31-18-11-9-17(10-12-18)16-5-2-1-3-6-16/h1-14H	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Displacement of FAM-Bid peptide from human Mcl-1 after 30 mins by competitive fluorescence polarization assay				Eur J Med Chem 46: 3909-16 (2011) Article DOI: 10.1016/j.ejmech.2011.05.062 BindingDB Entry DOI: 10.7270/Q2MK6D8W
					More data for this Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50336578 (3-(biphenyl-4-yloxy)-8-oxo-8H-acenaphtho[1,2-b]pyr...) Show SMILES O=c1nc2c3cccc4c(Oc5ccc(cc5)-c5ccccc5)ccc(c2c1C#N)c34 Show InChI InChI=1S/C27H14N2O2/c28-15-22-25-20-13-14-23(19-7-4-8-21(24(19)20)26(25)29-27(22)30)31-18-11-9-17(10-12-18)16-5-2-1-3-6-16/h1-14H	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Displacement of FAM-Bid from human Mcl-1 after 30 mins by fluorescence polarization assay				J Med Chem 54: 1101-5 (2011) Article DOI: 10.1021/jm101181u BindingDB Entry DOI: 10.7270/Q2RF5V96
					More data for this Ligand-Target Pair