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SMILES: NC1CCN(CC1)c1ccc(c(F)c1)-c1nc2snc(C3CCCCC3)c2c(=O)[nH]1

InChI Key: InChIKey=BIRFZKIJHKMWAB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50381312   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
High affinity cAMP-specific 3',5'-cyclic phosphodiesterase 7A


(Homo sapiens (Human))		BDBM50381312
PNG
(CHEMBL2019126)
Show SMILES NC1CCN(CC1)c1ccc(c(F)c1)-c1nc2snc(C3CCCCC3)c2c(=O)[nH]1
Show InChI InChI=1S/C22H26FN5OS/c23-17-12-15(28-10-8-14(24)9-11-28)6-7-16(17)20-25-21(29)18-19(27-30-22(18)26-20)13-4-2-1-3-5-13/h6-7,12-14H,1-5,8-11,24H2,(H,25,26,29)
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Article
PubMed
n/an/a 101n/an/an/an/an/an/a



Glenmark Pharmaceuticals Limited

Curated by ChEMBL


Assay Description
Displacement of [3H]-cAMP from human recombinant PDE7A

Bioorg Med Chem Lett 22: 3223-8 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.025
BindingDB Entry DOI: 10.7270/Q2NP25F2
More data for this
Ligand-Target Pair