BDBM50330855 2-(2-fluoro-4-(((1,2-cis)-2-hydroxycyclopentyl)methyl)phenyl)propanoic acid::CHEMBL1275970

SMILES: CC(C(O)=O)c1ccc(C[C@@H]2CCC[C@@H]2O)cc1F

InChI Key: InChIKey=SNSNKHOGRIQHBJ-PSADTEFUSA-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 = 50330855   

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
Cyclooxygenase (Homo sapiens (Human))	BDBM50330855 (2-(2-fluoro-4-(((1,2-cis)-2-hydroxycyclopentyl)met...) Show SMILES CC(C(O)=O)c1ccc(C[C@@H]2CCC[C@@H]2O)cc1F |r| Show InChI InChI=1S/C15H19FO3/c1-9(15(18)19)12-6-5-10(8-13(12)16)7-11-3-2-4-14(11)17/h5-6,8-9,11,14,17H,2-4,7H2,1H3,(H,18,19)/t9?,11-,14-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of COX2 in human whole blood assessed as PGE2 biosynthesis after 24 hrs by EIA				J Med Chem 53: 7879-82 (2010) Article DOI: 10.1021/jm101116s BindingDB Entry DOI: 10.7270/Q2WS8TGV
					More data for this Ligand-Target Pair
Cyclooxygenase-1 (COX-1) (Homo sapiens (Human))	BDBM50330855 (2-(2-fluoro-4-(((1,2-cis)-2-hydroxycyclopentyl)met...) Show SMILES CC(C(O)=O)c1ccc(C[C@@H]2CCC[C@@H]2O)cc1F |r| Show InChI InChI=1S/C15H19FO3/c1-9(15(18)19)12-6-5-10(8-13(12)16)7-11-3-2-4-14(11)17/h5-6,8-9,11,14,17H,2-4,7H2,1H3,(H,18,19)/t9?,11-,14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kumamoto University Curated by ChEMBL					Assay Description Inhibition of COX1 in human whole blood assessed as TXB2 biosynthesis after 24 hrs by EIA				J Med Chem 53: 7879-82 (2010) Article DOI: 10.1021/jm101116s BindingDB Entry DOI: 10.7270/Q2WS8TGV
					More data for this Ligand-Target Pair