BDBM15329 3-[4-({2-[(2,6-dichlorophenyl)methyl]-3-oxocyclohex-1-en-1-yl}amino)-2-fluorophenyl]-4,4-dimethyl-4,5-dihydro-1H-pyrazol-5-one::Aryldimethylpyrazolone 18h

SMILES: CC1(C)C(=O)NN=C1c1ccc(NC2=C(Cc3c(Cl)cccc3Cl)C(=O)CCC2)cc1F

InChI Key: InChIKey=GYQHUPCZPSPFKL-UHFFFAOYSA-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 = 15329   

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
Phosphodiesterase Type 3 (PDE3A) (Homo sapiens (Human))	BDBM15329 (3-[4-({2-[(2,6-dichlorophenyl)methyl]-3-oxocyclohe...) Show SMILES CC1(C)C(=O)NN=C1c1ccc(NC2=C(Cc3c(Cl)cccc3Cl)C(=O)CCC2)cc1F |c:6,14| Show InChI InChI=1S/C24H22Cl2FN3O2/c1-24(2)22(29-30-23(24)32)14-10-9-13(11-19(14)27)28-20-7-4-8-21(31)16(20)12-15-17(25)5-3-6-18(15)26/h3,5-6,9-11,28H,4,7-8,12H2,1-2H3,(H,30,32)	PDB KEGG DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories					Assay Description PDE activity was monitored by measuring the hydrolysis of [3H]-cAMP to [3H]-AMP using scintillation proximity assay (SPA). [3H]-AMP was captured by t...				Bioorg Med Chem Lett 13: 3983-7 (2003) Article DOI: 10.1016/j.bmcl.2003.08.056 BindingDB Entry DOI: 10.7270/Q2JD4V11
					More data for this Ligand-Target Pair
Phosphodiesterase Type 3 (PDE3B) (Homo sapiens (Human))	BDBM15329 (3-[4-({2-[(2,6-dichlorophenyl)methyl]-3-oxocyclohe...) Show SMILES CC1(C)C(=O)NN=C1c1ccc(NC2=C(Cc3c(Cl)cccc3Cl)C(=O)CCC2)cc1F |c:6,14| Show InChI InChI=1S/C24H22Cl2FN3O2/c1-24(2)22(29-30-23(24)32)14-10-9-13(11-19(14)27)28-20-7-4-8-21(31)16(20)12-15-17(25)5-3-6-18(15)26/h3,5-6,9-11,28H,4,7-8,12H2,1-2H3,(H,30,32)	PDB MMDB KEGG B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.130	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories					Assay Description PDE activity was monitored by measuring the hydrolysis of [3H]-cAMP to [3H]-AMP using scintillation proximity assay (SPA). [3H]-AMP was captured by t...				Bioorg Med Chem Lett 13: 3983-7 (2003) Article DOI: 10.1016/j.bmcl.2003.08.056 BindingDB Entry DOI: 10.7270/Q2JD4V11
					More data for this Ligand-Target Pair