BDBM50334679 CHEMBL1642599::N-((4S)-4-(3-amino-3-oxopropyl)-4-(pyridin-2-yl)cyclohexyl)-N-cyclopropyl-4-((S)-1,1,1-trifluoro-2-hydroxypropan-2-yl)benzamide

SMILES: C[C@](O)(c1ccc(cc1)C(=O)N(C1CC1)[C@H]1CC[C@@](CCC(N)=O)(CC1)c1ccccn1)C(F)(F)F

InChI Key: InChIKey=YMVRFHWORXWHNT-MZBJOSPHSA-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 = 50334679   

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))	BDBM50334679 (CHEMBL1642599 | N-((4S)-4-(3-amino-3-oxopropyl)-4-...) Show SMILES C[C@](O)(c1ccc(cc1)C(=O)N(C1CC1)[C@H]1CC[C@@](CCC(N)=O)(CC1)c1ccccn1)C(F)(F)F |r,wU:1.0,15.16,wD:1.1,18.28,(-9.42,-25.72,;-8.09,-24.94,;-9.58,-24.55,;-6.75,-25.71,;-5.42,-24.93,;-4.09,-25.7,;-4.09,-27.24,;-5.41,-28.01,;-6.74,-27.25,;-2.75,-28,;-2.75,-29.54,;-1.42,-27.23,;-1.43,-25.69,;-.66,-24.36,;-2.2,-24.36,;-.09,-27.99,;1.24,-27.22,;2.57,-27.99,;2.57,-29.54,;3.99,-28.94,;5.21,-29.88,;6.64,-29.29,;7.86,-30.22,;6.83,-27.76,;1.24,-30.3,;-.09,-29.53,;3.33,-30.86,;4.85,-30.87,;5.61,-32.19,;4.84,-33.52,;3.31,-33.51,;2.55,-32.18,;-8.1,-23.4,;-6.77,-22.63,;-9.43,-22.64,;-8.5,-21.92,)| Show InChI InChI=1S/C27H32F3N3O3/c1-25(36,27(28,29)30)19-7-5-18(6-8-19)24(35)33(20-9-10-20)21-11-14-26(15-12-21,16-13-23(31)34)22-4-2-3-17-32-22/h2-8,17,20-21,36H,9-16H2,1H3,(H2,31,34)/t21-,25-,26-/m0/s1	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	>100	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc Curated by ChEMBL					Assay Description Inhibition of human recombinant full length 11beta-HSD1 expressed in human adipocytes assessed as inhibition of conversion of [3H]cortisone to [3H]co...				Bioorg Med Chem Lett 21: 405-10 (2010) Article DOI: 10.1016/j.bmcl.2010.10.129 BindingDB Entry DOI: 10.7270/Q2K937SB
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM50334679 (CHEMBL1642599 | N-((4S)-4-(3-amino-3-oxopropyl)-4-...) Show SMILES C[C@](O)(c1ccc(cc1)C(=O)N(C1CC1)[C@H]1CC[C@@](CCC(N)=O)(CC1)c1ccccn1)C(F)(F)F |r,wU:1.0,15.16,wD:1.1,18.28,(-9.42,-25.72,;-8.09,-24.94,;-9.58,-24.55,;-6.75,-25.71,;-5.42,-24.93,;-4.09,-25.7,;-4.09,-27.24,;-5.41,-28.01,;-6.74,-27.25,;-2.75,-28,;-2.75,-29.54,;-1.42,-27.23,;-1.43,-25.69,;-.66,-24.36,;-2.2,-24.36,;-.09,-27.99,;1.24,-27.22,;2.57,-27.99,;2.57,-29.54,;3.99,-28.94,;5.21,-29.88,;6.64,-29.29,;7.86,-30.22,;6.83,-27.76,;1.24,-30.3,;-.09,-29.53,;3.33,-30.86,;4.85,-30.87,;5.61,-32.19,;4.84,-33.52,;3.31,-33.51,;2.55,-32.18,;-8.1,-23.4,;-6.77,-22.63,;-9.43,-22.64,;-8.5,-21.92,)| Show InChI InChI=1S/C27H32F3N3O3/c1-25(36,27(28,29)30)19-7-5-18(6-8-19)24(35)33(20-9-10-20)21-11-14-26(15-12-21,16-13-23(31)34)22-4-2-3-17-32-22/h2-8,17,20-21,36H,9-16H2,1H3,(H2,31,34)/t21-,25-,26-/m0/s1	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	9.60	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc Curated by ChEMBL					Assay Description Inhibition of human full length 11beta-HSD1 assessed as inhibition of conversion of [3H]cortisone to [3H]cortisol by scintillation proximity assay				Bioorg Med Chem Lett 21: 405-10 (2010) Article DOI: 10.1016/j.bmcl.2010.10.129 BindingDB Entry DOI: 10.7270/Q2K937SB
					More data for this Ligand-Target Pair