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SMILES: COc1cc(N)ccc1-c1nc2snc(-c3c(F)cccc3Cl)c2c(=O)[nH]1

InChI Key: InChIKey=OPNWVCDOFQMMLP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50381317   
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))		BDBM50381317
PNG
(CHEMBL2019134)
Show SMILES COc1cc(N)ccc1-c1nc2snc(-c3c(F)cccc3Cl)c2c(=O)[nH]1 |(-1.75,-41.75,;-.41,-40.98,;.92,-41.75,;2.25,-40.98,;3.59,-41.76,;4.92,-40.99,;3.58,-43.3,;2.25,-44.06,;.92,-43.29,;-.41,-44.05,;-1.74,-43.27,;-3.07,-44.04,;-4.55,-43.56,;-5.46,-44.82,;-4.55,-46.07,;-5.02,-47.53,;-6.53,-47.84,;-7.55,-46.7,;-7,-49.31,;-5.97,-50.45,;-4.46,-50.13,;-3.99,-48.66,;-2.66,-49.43,;-3.07,-45.59,;-1.74,-46.35,;-1.74,-47.89,;-.41,-45.59,)|
Show InChI InChI=1S/C18H12ClFN4O2S/c1-26-12-7-8(21)5-6-9(12)16-22-17(25)14-15(24-27-18(14)23-16)13-10(19)3-2-4-11(13)20/h2-7H,21H2,1H3,(H,22,23,25)
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MMDB

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Article
PubMed
n/an/a 14n/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