BDBM50112135 CHEMBL3609863

SMILES: NC(=O)C12CC3CC(C1)[C@H](NC(=O)CNS(=O)(=O)c1ccccc1F)C(C3)C2

InChI Key: InChIKey=OSQQBHPQMWOBCP-XEMAOCGYSA-N

Data: 2 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 2 hits for monomerid = 50112135   

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 (Mus musculus (mouse))	BDBM50112135 (CHEMBL3609863) Show SMILES NC(=O)C12CC3CC(C1)[C@H](NC(=O)CNS(=O)(=O)c1ccccc1F)C(C3)C2 |r,wD:9.10,TLB:26:25:8:4.6.5,THB:26:5:8:9.25.27,10:9:8:4.6.5,9:25:4:8.6.7,9:7:4:25.26.27,(3.78,.15,;3.07,1.15,;3.59,2.27,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-4.99,.63,;-6.03,-1.55,;-7.46,-.97,;-8.67,-1.93,;-7.53,-2.38,;-8.49,-3.15,;-10.1,-1.35,;-10.32,.17,;-11.75,.74,;-12.96,-.21,;-12.74,-1.74,;-11.31,-2.31,;-11.14,-3.53,;-1.2,1.02,;-1.2,2.69,;.34,.44,)| Show InChI InChI=1S/C19H24FN3O4S/c20-14-3-1-2-4-15(14)28(26,27)22-10-16(24)23-17-12-5-11-6-13(17)9-19(7-11,8-12)18(21)25/h1-4,11-13,17,22H,5-10H2,(H2,21,25)(H,23,24)/t11?,12?,13?,17-,19?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Incheon National University Curated by ChEMBL					Assay Description Inhibition of mouse 11beta-HSD1				Bioorg Med Chem Lett 25: 3501-6 (2015) BindingDB Entry DOI: 10.7270/Q2BP04KW
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM50112135 (CHEMBL3609863) Show SMILES NC(=O)C12CC3CC(C1)[C@H](NC(=O)CNS(=O)(=O)c1ccccc1F)C(C3)C2 |r,wD:9.10,TLB:26:25:8:4.6.5,THB:26:5:8:9.25.27,10:9:8:4.6.5,9:25:4:8.6.7,9:7:4:25.26.27,(3.78,.15,;3.07,1.15,;3.59,2.27,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-4.99,.63,;-6.03,-1.55,;-7.46,-.97,;-8.67,-1.93,;-7.53,-2.38,;-8.49,-3.15,;-10.1,-1.35,;-10.32,.17,;-11.75,.74,;-12.96,-.21,;-12.74,-1.74,;-11.31,-2.31,;-11.14,-3.53,;-1.2,1.02,;-1.2,2.69,;.34,.44,)| Show InChI InChI=1S/C19H24FN3O4S/c20-14-3-1-2-4-15(14)28(26,27)22-10-16(24)23-17-12-5-11-6-13(17)9-19(7-11,8-12)18(21)25/h1-4,11-13,17,22H,5-10H2,(H2,21,25)(H,23,24)/t11?,12?,13?,17-,19?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Incheon National University Curated by ChEMBL					Assay Description Inhibition of human 11beta-HSD1				Bioorg Med Chem Lett 25: 3501-6 (2015) BindingDB Entry DOI: 10.7270/Q2BP04KW
					More data for this Ligand-Target Pair