BDBM50454597 CHEMBL4211919

SMILES: CC(=O)Oc1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1

InChI Key: InChIKey=CGLOJKDYHQYEQJ-RZDIXWSQSA-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 = 50454597   

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
Fatty-acid amide hydrolase 1 (Homo sapiens (Human))	BDBM50454597 (CHEMBL4211919) Show SMILES CC(=O)Oc1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:9.8,wD:12.15,(25.82,-10.05,;24.48,-9.28,;24.49,-7.74,;23.15,-10.05,;21.82,-9.28,;20.48,-10.05,;19.15,-9.27,;19.16,-7.73,;17.83,-6.96,;16.49,-7.73,;16.48,-9.27,;15.16,-10.03,;13.83,-9.26,;13.82,-7.73,;15.16,-6.96,;12.49,-10.03,;11.16,-9.26,;11.16,-7.72,;9.83,-10.03,;8.49,-9.27,;7.16,-10.04,;5.82,-9.27,;5.82,-7.72,;4.49,-6.95,;4.49,-5.41,;4.49,-4.01,;5.74,-4.4,;3.24,-4.4,;7.15,-6.95,;8.49,-7.72,;20.48,-6.97,;21.81,-7.73,)| Show InChI InChI=1S/C22H23F3N2O5/c1-14(28)30-17-10-12-19(13-11-17)31-18-6-2-15(3-7-18)26-21(29)27-16-4-8-20(9-5-16)32-22(23,24)25/h4-5,8-13,15,18H,2-3,6-7H2,1H3,(H2,26,27,29)/t15-,18-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
University of California Davis Curated by ChEMBL					Assay Description Inhibition of human FAAH expressed in baculovirus-infected High Five cells S9 fraction using OMP substrate by fluorescence based assay				Bioorg Med Chem Lett 28: 762-768 (2018) Article DOI: 10.1016/j.bmcl.2018.01.003 BindingDB Entry DOI: 10.7270/Q2PV6NZ4
					More data for this Ligand-Target Pair
Bifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50454597 (CHEMBL4211919) Show SMILES CC(=O)Oc1ccc(O[C@H]2CC[C@@H](CC2)NC(=O)Nc2ccc(OC(F)(F)F)cc2)cc1 |r,wU:9.8,wD:12.15,(25.82,-10.05,;24.48,-9.28,;24.49,-7.74,;23.15,-10.05,;21.82,-9.28,;20.48,-10.05,;19.15,-9.27,;19.16,-7.73,;17.83,-6.96,;16.49,-7.73,;16.48,-9.27,;15.16,-10.03,;13.83,-9.26,;13.82,-7.73,;15.16,-6.96,;12.49,-10.03,;11.16,-9.26,;11.16,-7.72,;9.83,-10.03,;8.49,-9.27,;7.16,-10.04,;5.82,-9.27,;5.82,-7.72,;4.49,-6.95,;4.49,-5.41,;4.49,-4.01,;5.74,-4.4,;3.24,-4.4,;7.15,-6.95,;8.49,-7.72,;20.48,-6.97,;21.81,-7.73,)| Show InChI InChI=1S/C22H23F3N2O5/c1-14(28)30-17-10-12-19(13-11-17)31-18-6-2-15(3-7-18)26-21(29)27-16-4-8-20(9-5-16)32-22(23,24)25/h4-5,8-13,15,18H,2-3,6-7H2,1H3,(H2,26,27,29)/t15-,18-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
University of California Davis Curated by ChEMBL					Assay Description Inhibition of human recombinant soluble epoxide hydrolase expressed in baculovirus-infected High Five cells S9 fraction using CMNPC substrate by fluo...				Bioorg Med Chem Lett 28: 762-768 (2018) Article DOI: 10.1016/j.bmcl.2018.01.003 BindingDB Entry DOI: 10.7270/Q2PV6NZ4
					More data for this Ligand-Target Pair