BDBM107651 US8575157, 22

SMILES: COC[C@@](C)(O)C[C@@]1(CCN([C@@H](C)c2ccc(cc2)-c2ccn(C)c(=O)c2)C(=O)O1)c1ccccc1

InChI Key: InChIKey=YCQOHFSEUJSSTM-IZKCBNJNSA-N

Data: 4 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 4 hits for monomerid = 107651   

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))	BDBM107651 (US8575157, 22) Show SMILES COC[C@@](C)(O)C[C@@]1(CCN([C@@H](C)c2ccc(cc2)-c2ccn(C)c(=O)c2)C(=O)O1)c1ccccc1 |r| Show InChI InChI=1S/C29H34N2O5/c1-21(22-10-12-23(13-11-22)24-14-16-30(3)26(32)18-24)31-17-15-29(36-27(31)33,19-28(2,34)20-35-4)25-8-6-5-7-9-25/h5-14,16,18,21,34H,15,17,19-20H2,1-4H3/t21-,28-,29-/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	14.9	n/a	n/a	n/a	n/a	n/a	n/a
Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International, GmbH US Patent					Assay Description The inhibition of a microsomal preparation of 11β-HSD1 by compounds of the invention was measured essentially as previously described (K. Solly,...				US Patent US8575157 (2013) BindingDB Entry DOI: 10.7270/Q2416VPS
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM107651 (US8575157, 22) Show SMILES COC[C@@](C)(O)C[C@@]1(CCN([C@@H](C)c2ccc(cc2)-c2ccn(C)c(=O)c2)C(=O)O1)c1ccccc1 |r| Show InChI InChI=1S/C29H34N2O5/c1-21(22-10-12-23(13-11-22)24-14-16-30(3)26(32)18-24)31-17-15-29(36-27(31)33,19-28(2,34)20-35-4)25-8-6-5-7-9-25/h5-14,16,18,21,34H,15,17,19-20H2,1-4H3/t21-,28-,29-/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	20.1	n/a	n/a	n/a	n/a	n/a	n/a
Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International, GmbH US Patent					Assay Description Inhibition assay using 11β-HSD1 in the presence of 50% human plasma.				US Patent US8575157 (2013) BindingDB Entry DOI: 10.7270/Q2416VPS
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM107651 (US8575157, 22) Show SMILES COC[C@@](C)(O)C[C@@]1(CCN([C@@H](C)c2ccc(cc2)-c2ccn(C)c(=O)c2)C(=O)O1)c1ccccc1 |r| Show InChI InChI=1S/C29H34N2O5/c1-21(22-10-12-23(13-11-22)24-14-16-30(3)26(32)18-24)31-17-15-29(36-27(31)33,19-28(2,34)20-35-4)25-8-6-5-7-9-25/h5-14,16,18,21,34H,15,17,19-20H2,1-4H3/t21-,28-,29-/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	75.9	n/a	n/a	n/a	n/a	n/a	n/a
Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International, GmbH US Patent					Assay Description Inhibition assay using 11β-HSD1 in the presence of 50% human plasma.				US Patent US8575157 (2013) BindingDB Entry DOI: 10.7270/Q2416VPS
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM107651 (US8575157, 22) Show SMILES COC[C@@](C)(O)C[C@@]1(CCN([C@@H](C)c2ccc(cc2)-c2ccn(C)c(=O)c2)C(=O)O1)c1ccccc1 |r| Show InChI InChI=1S/C29H34N2O5/c1-21(22-10-12-23(13-11-22)24-14-16-30(3)26(32)18-24)31-17-15-29(36-27(31)33,19-28(2,34)20-35-4)25-8-6-5-7-9-25/h5-14,16,18,21,34H,15,17,19-20H2,1-4H3/t21-,28-,29-/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	6.60	n/a	n/a	n/a	n/a	n/a	n/a
Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International, GmbH US Patent					Assay Description The inhibition of a microsomal preparation of 11β-HSD1 by compounds of the invention was measured essentially as previously described (K. Solly,...				US Patent US8575157 (2013) BindingDB Entry DOI: 10.7270/Q2416VPS
					More data for this Ligand-Target Pair