BDBM50424220 CHEMBL2312477

SMILES: CCCCCNc1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34

InChI Key: InChIKey=OBOMQVHVCNBULB-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 = 50424220   

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
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50424220 (CHEMBL2312477) Show SMILES CCCCCNc1c2c3ccc(N4CCSCC4)c4cccc(c2nc1=O)c34 Show InChI InChI=1S/C23H25N3OS/c1-2-3-4-10-24-22-20-16-8-9-18(26-11-13-28-14-12-26)15-6-5-7-17(19(15)16)21(20)25-23(22)27/h5-9H,2-4,10-14H2,1H3,(H,24,25,27)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
Dalian University of Technology Curated by ChEMBL					Assay Description Binding affinity to cMcl-1 (residues 171 to 327) (unknown origin) by biotin-Bim displacement based ELISA				Bioorg Med Chem 21: 11-20 (2012) Article DOI: 10.1016/j.bmc.2012.11.008 BindingDB Entry DOI: 10.7270/Q25X2B7H
					More data for this Ligand-Target Pair