BDBM50400161 CHEMBL2179441

SMILES: CC(C)Oc1nc(NC2COC2)ncc1C(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2

InChI Key: InChIKey=SDGHFCUTUDEKMN-JFCQCOQKSA-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 = 50400161   

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))	BDBM50400161 (CHEMBL2179441) Show SMILES CC(C)Oc1nc(NC2COC2)ncc1C(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2 |r,wU:18.19,wD:25.28,TLB:26:25:18:22.21.20,17:18:28.24.25:22.21.20,17:18:20:28.25.27,THB:26:25:18.23.22:20,27:25:18:22.21.20,27:21:18:28.24.25,24:23:20:28.25.27,24:25:18.23.22:20,(68.49,-40.84,;67.16,-40.07,;65.82,-40.85,;67.16,-38.53,;65.82,-37.76,;64.48,-38.54,;63.15,-37.77,;61.81,-38.53,;60.47,-37.76,;60.08,-36.27,;58.59,-36.67,;58.99,-38.16,;63.15,-36.22,;64.48,-35.45,;65.81,-36.21,;67.15,-35.44,;67.14,-33.89,;68.48,-36.2,;69.82,-35.42,;69.81,-33.68,;68.77,-32.6,;69.43,-31.33,;69.45,-32.77,;70.62,-34.1,;72.03,-33.53,;71.89,-31.91,;73.42,-31.92,;70.84,-30.78,;71.11,-33.12,)| Show InChI InChI=1S/C21H30N4O4/c1-11(2)29-19-16(8-22-20(25-19)23-15-9-28-10-15)18(26)24-17-13-3-12-4-14(17)7-21(27,5-12)6-13/h8,11-15,17,27H,3-7,9-10H2,1-2H3,(H,24,26)(H,22,23,25)/t12?,13?,14?,17-,21-	PDB MMDB 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	13	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of human 11beta-HSD1 by HTRF assay				J Med Chem 55: 10652-61 (2012) Article DOI: 10.1021/jm3013163 BindingDB Entry DOI: 10.7270/Q2BG2Q4S
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mus musculus (mouse))	BDBM50400161 (CHEMBL2179441) Show SMILES CC(C)Oc1nc(NC2COC2)ncc1C(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2 |r,wU:18.19,wD:25.28,TLB:26:25:18:22.21.20,17:18:28.24.25:22.21.20,17:18:20:28.25.27,THB:26:25:18.23.22:20,27:25:18:22.21.20,27:21:18:28.24.25,24:23:20:28.25.27,24:25:18.23.22:20,(68.49,-40.84,;67.16,-40.07,;65.82,-40.85,;67.16,-38.53,;65.82,-37.76,;64.48,-38.54,;63.15,-37.77,;61.81,-38.53,;60.47,-37.76,;60.08,-36.27,;58.59,-36.67,;58.99,-38.16,;63.15,-36.22,;64.48,-35.45,;65.81,-36.21,;67.15,-35.44,;67.14,-33.89,;68.48,-36.2,;69.82,-35.42,;69.81,-33.68,;68.77,-32.6,;69.43,-31.33,;69.45,-32.77,;70.62,-34.1,;72.03,-33.53,;71.89,-31.91,;73.42,-31.92,;70.84,-30.78,;71.11,-33.12,)| Show InChI InChI=1S/C21H30N4O4/c1-11(2)29-19-16(8-22-20(25-19)23-15-9-28-10-15)18(26)24-17-13-3-12-4-14(17)7-21(27,5-12)6-13/h8,11-15,17,27H,3-7,9-10H2,1-2H3,(H,24,26)(H,22,23,25)/t12?,13?,14?,17-,21-	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Inhibition of mouse 11beta-HSD1 by HTRF assay				J Med Chem 55: 10652-61 (2012) Article DOI: 10.1021/jm3013163 BindingDB Entry DOI: 10.7270/Q2BG2Q4S
					More data for this Ligand-Target Pair