BDBM50340256 CHEMBL1760608

SMILES: Cc1c2CNCCCCNc3cc(ccc3C(N)=O)-n2c2CC(C)(C)CC(=O)c12

InChI Key: InChIKey=LAXQKYDCHHCCKI-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 = 50340256   

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
Heat shock protein HSP 90-alpha (Homo sapiens (Human))	BDBM50340256 (CHEMBL1760608) Show SMILES Cc1c2CNCCCCNc3cc(ccc3C(N)=O)-n2c2CC(C)(C)CC(=O)c12 Show InChI InChI=1S/C23H30N4O2/c1-14-19-13-25-8-4-5-9-26-17-10-15(6-7-16(17)22(24)29)27(19)18-11-23(2,3)12-20(28)21(14)18/h6-7,10,25-26H,4-5,8-9,11-13H2,1-3H3,(H2,24,29)	PDB MMDB NCI pathway 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	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of Hsp90alpha after 3 hrs by fluorescence polarization assay				Bioorg Med Chem Lett 21: 2278-82 (2011) Article DOI: 10.1016/j.bmcl.2011.02.101 BindingDB Entry DOI: 10.7270/Q2RF5VBN
					More data for this Ligand-Target Pair