BDBM99465 US8497281, 243

SMILES: Cc1cc2C[C@@H]3[C@@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1C#N

InChI Key: InChIKey=WAGZLEPKWTWONO-LAUBAEHRSA-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 = 99465   

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
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM99465 (US8497281, 243) Show SMILES Cc1cc2C[C@@H]3[C@@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1C#N |r| Show InChI InChI=1S/C22H20N4O/c1-13-7-15-10-21-17(18(15)8-16(13)11-23)3-2-6-26(21)22(27)14-4-5-19-20(9-14)25-12-24-19/h4-5,7-9,12,17,21H,2-3,6,10H2,1H3,(H,24,25)/t17-,21+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	58.4	n/a	n/a	n/a	n/a	6.0	37
Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH US Patent					Assay Description In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...				US Patent US8497281 (2013) BindingDB Entry DOI: 10.7270/Q2G44NXT
					More data for this Ligand-Target Pair