BDBM99442 US8497281, 220

SMILES: Cc1cc2nc[nH]c2cc1C(=O)N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C#N

InChI Key: InChIKey=BHZWMARTZWSRNI-IERDGZPVSA-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 = 99442   

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))	BDBM99442 (US8497281, 220) Show SMILES Cc1cc2nc[nH]c2cc1C(=O)N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C#N |r| Show InChI InChI=1S/C22H20N4O/c1-13-7-19-20(25-12-24-19)10-17(13)22(27)26-6-2-3-16-18-8-14(11-23)4-5-15(18)9-21(16)26/h4-5,7-8,10,12,16,21H,2-3,6,9H2,1H3,(H,24,25)/t16-,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	48	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