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SMILES: Cc1cccc(n1)C#Cc1ccc(cc1)-c1c(cnn1C)-c1ccncc1

InChI Key: InChIKey=XXCQAXXQJAEKBI-UHFFFAOYSA-N

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 1 hit for monomerid = 347654   
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
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A


(Homo sapiens (Human))
BDBM347654
PNG
(2-methyl-6-[2-[4-[2-methyl-4-(4-pyridyl)pyrazol-3-...)
Show SMILES Cc1cccc(n1)C#Cc1ccc(cc1)-c1c(cnn1C)-c1ccncc1
Show InChI InChI=1S/C23H18N4/c1-17-4-3-5-21(26-17)11-8-18-6-9-20(10-7-18)23-22(16-25-27(23)2)19-12-14-24-15-13-19/h3-7,9-10,12-16H,1-2H3
PDB
MMDB

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US Patent
n/an/a<100n/an/an/an/an/an/a



ABBVIE INC.; ABBVIE DEUTSCHLAND GMBH & CO. KG

US Patent


Assay Description
The PDE enzymatic reaction was carried out in assay buffer (20 mM Tris-HCl pH7.5, 10 mM MgCl2, 0.1% bovine serum albumin) containing enzyme and subst...


US Patent US9790203 (2017)


BindingDB Entry DOI: 10.7270/Q2ZG6VD4
More data for this
Ligand-Target Pair