BDBM50400763 CHEMBL2204275

SMILES: O[C@H]1CCCC[C@@H]1NC(=O)c1cc(CN2CCN(CC2)c2ccc(cc2)C#N)c2ccccn2c1=O

InChI Key: InChIKey=XXODCMADFJBDQF-AHWVRZQESA-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 = 50400763   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50400763 (CHEMBL2204275) Show SMILES O[C@H]1CCCC[C@@H]1NC(=O)c1cc(CN2CCN(CC2)c2ccc(cc2)C#N)c2ccccn2c1=O |r| Show InChI InChI=1S/C28H31N5O3/c29-18-20-8-10-22(11-9-20)32-15-13-31(14-16-32)19-21-17-23(28(36)33-12-4-3-6-25(21)33)27(35)30-24-5-1-2-7-26(24)34/h3-4,6,8-12,17,24,26,34H,1-2,5,7,13-16,19H2,(H,30,35)/t24-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to human ERG				ACS Med Chem Lett 3: 1070-1074 (2012) Article DOI: 10.1021/ml300280g BindingDB Entry DOI: 10.7270/Q2X34ZM6
					More data for this Ligand-Target Pair