BDBM236645 US9388139, 14

SMILES: CC(C)(C)C1=NN(C(C1)c1ccccc1Br)c1ccc(cc1)C(O)=O

InChI Key: InChIKey=OEISQMKGRTXAIX-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 236645   

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
cGMP-specific 3',5'-cyclic phosphodiesterase (Homo sapiens (Human))	BDBM236645 (US9388139, 14) Show SMILES CC(C)(C)C1=NN(C(C1)c1ccccc1Br)c1ccc(cc1)C(O)=O |t:4| Show InChI InChI=1S/C20H21BrN2O2/c1-20(2,3)18-12-17(15-6-4-5-7-16(15)21)23(22-18)14-10-8-13(9-11-14)19(24)25/h4-11,17H,12H2,1-3H3,(H,24,25)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
German University; Southern Research Institute US Patent					Assay Description PDE activity was measured using the IMAP fluorescence polarization assay (Molecular Devices) in which binding of hydrolyzed cyclic nucleotide substra...				US Patent US9388139 (2016) BindingDB Entry DOI: 10.7270/Q2GF0SFS
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 2 (Homo sapiens (Human))	BDBM236645 (US9388139, 14) Show SMILES CC(C)(C)C1=NN(C(C1)c1ccccc1Br)c1ccc(cc1)C(O)=O |t:4| Show InChI InChI=1S/C20H21BrN2O2/c1-20(2,3)18-12-17(15-6-4-5-7-16(15)21)23(22-18)14-10-8-13(9-11-14)19(24)25/h4-11,17H,12H2,1-3H3,(H,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
German University; Southern Research Institute US Patent					Assay Description The activities of COX-1 and COX-2 were measured after the addition of arachidonic acid and incubation at 25° C. for 5 min by absorbance at 590 nm as ...				US Patent US9388139 (2016) BindingDB Entry DOI: 10.7270/Q2GF0SFS
					More data for this Ligand-Target Pair
Prostaglandin G/H synthase 1 (Homo sapiens (Human))	BDBM236645 (US9388139, 14) Show SMILES CC(C)(C)C1=NN(C(C1)c1ccccc1Br)c1ccc(cc1)C(O)=O |t:4| Show InChI InChI=1S/C20H21BrN2O2/c1-20(2,3)18-12-17(15-6-4-5-7-16(15)21)23(22-18)14-10-8-13(9-11-14)19(24)25/h4-11,17H,12H2,1-3H3,(H,24,25)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
German University; Southern Research Institute US Patent					Assay Description The activities of COX-1 and COX-2 were measured after the addition of arachidonic acid and incubation at 25° C. for 5 min by absorbance at 590 nm as ...				US Patent US9388139 (2016) BindingDB Entry DOI: 10.7270/Q2GF0SFS
					More data for this Ligand-Target Pair