BDBM193172 US9193736, 88

SMILES: OC(=O)c1cccc(c1)-c1c(nc2c(ccnn12)N1CCOCC1)C#Cc1ccc2ccccc2n1

InChI Key: InChIKey=DUMOKAMEXOZZNO-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 = 193172   

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 10A (PDE10A2) (Homo sapiens (Human))	BDBM193172 (US9193736, 88) Show SMILES OC(=O)c1cccc(c1)-c1c(nc2c(ccnn12)N1CCOCC1)C#Cc1ccc2ccccc2n1 Show InChI InChI=1S/C28H21N5O3/c34-28(35)21-6-3-5-20(18-21)26-24(11-10-22-9-8-19-4-1-2-7-23(19)30-22)31-27-25(12-13-29-33(26)27)32-14-16-36-17-15-32/h1-9,12-13,18H,14-17H2,(H,34,35)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<1	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica, NV US Patent					Assay Description Human recombinant PDE10A2 was expressed in Sf9 cells, using a recombinant baculovirus construct containing the full length sequence containing a 6ÿH...				US Patent US9193736 (2015) BindingDB Entry DOI: 10.7270/Q2XK8DCS
					More data for this Ligand-Target Pair
Phosphodiesterase Type 10 (PDE10A) (Rattus norvegicus (rat))	BDBM193172 (US9193736, 88) Show SMILES OC(=O)c1cccc(c1)-c1c(nc2c(ccnn12)N1CCOCC1)C#Cc1ccc2ccccc2n1 Show InChI InChI=1S/C28H21N5O3/c34-28(35)21-6-3-5-20(18-21)26-24(11-10-22-9-8-19-4-1-2-7-23(19)30-22)31-27-25(12-13-29-33(26)27)32-14-16-36-17-15-32/h1-9,12-13,18H,14-17H2,(H,34,35)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<1	n/a	n/a	n/a	n/a	7.8	n/a
Janssen Pharmaceutica, NV US Patent					Assay Description Rat recombinant PDE10a (rPDE10a) was expressed in Sf9 cells using a recombinant rPDE10a baculovirus construct. Cells were harvested after 48 h of inf...				US Patent US9193736 (2015) BindingDB Entry DOI: 10.7270/Q2XK8DCS
					More data for this Ligand-Target Pair