BDBM347645 6-[2-[4-[1-methyl-4-(4-pyridyl)pyrazol-3-yl]phenyl]ethynyl]-1H-pyrrolo[2,3-b]pyridine::US9790203, Example 15

SMILES: Cn1cc(c(n1)-c1ccc(cc1)C#Cc1ccc2cc[nH]c2n1)-c1ccncc1

InChI Key: InChIKey=RRDKHZIOLKZGDS-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 347645   

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
cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A (Homo sapiens (Human))	BDBM347645 (6-[2-[4-[1-methyl-4-(4-pyridyl)pyrazol-3-yl]phenyl...) Show SMILES Cn1cc(c(n1)-c1ccc(cc1)C#Cc1ccc2cc[nH]c2n1)-c1ccncc1 Show InChI InChI=1S/C24H17N5/c1-29-16-22(18-10-13-25-14-11-18)23(28-29)19-5-2-17(3-6-19)4-8-21-9-7-20-12-15-26-24(20)27-21/h2-3,5-7,9-16H,1H3,(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	n/a	n/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
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