BDBM50268375 1-Pyridin-4-ylmethyl-4-(4-pyridin-2-ylpiperazin-1-yl)phthalazine::CHEMBL497003

SMILES C(c1ccncc1)c1nnc(N2CCN(CC2)c2ccccn2)c2ccccc12

InChI Key InChIKey=HVCKRXNCZNJASA-UHFFFAOYSA-N

Data  4 IC50

Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50268375   

TargetSmoothened homolog(Mus musculus)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50268375(1-Pyridin-4-ylmethyl-4-(4-pyridin-2-ylpiperazin-1-...)
Show SMILES C(c1ccncc1)c1nnc(N2CCN(CC2)c2ccccn2)c2ccccc12
Show InChI InChI=1S/C23H22N6/c1-2-6-20-19(5-1)21(17-18-8-11-24-12-9-18)26-27-23(20)29-15-13-28(14-16-29)22-7-3-4-10-25-22/h1-12H,13-17H2
Affinity DataIC50: 690nMAssay Description:Inhibition of Smoothened receptor in mouse TM3 cells transfected with pTA-8xGli-Luc reporter gene assessed as inhibition of 1 nM 3-chloro-4,7-difluor...More data for this Ligand-Target Pair
TargetSmoothened homolog(Homo sapiens (Human))
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50268375(1-Pyridin-4-ylmethyl-4-(4-pyridin-2-ylpiperazin-1-...)
Show SMILES C(c1ccncc1)c1nnc(N2CCN(CC2)c2ccccn2)c2ccccc12
Show InChI InChI=1S/C23H22N6/c1-2-6-20-19(5-1)21(17-18-8-11-24-12-9-18)26-27-23(20)29-15-13-28(14-16-29)22-7-3-4-10-25-22/h1-12H,13-17H2
Affinity DataIC50: 5.00E+3nMAssay Description:Displacement of [3H]3-chloro-4,7-difluoro-N-(4-methoxy-3-(pyridin-4-yl)benzyl)-N-(4-(methylamino)cyclohexyl)benzo[b]thiophene-2-carboxamide from huma...More data for this Ligand-Target Pair
TargetSmoothened homolog(Mus musculus)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50268375(1-Pyridin-4-ylmethyl-4-(4-pyridin-2-ylpiperazin-1-...)
Show SMILES C(c1ccncc1)c1nnc(N2CCN(CC2)c2ccccn2)c2ccccc12
Show InChI InChI=1S/C23H22N6/c1-2-6-20-19(5-1)21(17-18-8-11-24-12-9-18)26-27-23(20)29-15-13-28(14-16-29)22-7-3-4-10-25-22/h1-12H,13-17H2
Affinity DataIC50: 3.69E+3nMAssay Description:Displacement of [3H]3-chloro-4,7-difluoro-N-(4-methoxy-3-(pyridin-4-yl)benzyl)-N-(4-(methylamino)cyclohexyl)benzo[b]thiophene-2-carboxamide from mous...More data for this Ligand-Target Pair
TargetSmoothened homolog(Mus musculus)
Novartis Institutes for BioMedical Research

Curated by ChEMBL
LigandPNGBDBM50268375(1-Pyridin-4-ylmethyl-4-(4-pyridin-2-ylpiperazin-1-...)
Show SMILES C(c1ccncc1)c1nnc(N2CCN(CC2)c2ccccn2)c2ccccc12
Show InChI InChI=1S/C23H22N6/c1-2-6-20-19(5-1)21(17-18-8-11-24-12-9-18)26-27-23(20)29-15-13-28(14-16-29)22-7-3-4-10-25-22/h1-12H,13-17H2
Affinity DataIC50: 4.49E+3nMAssay Description:Inhibition of Smoothened receptor in mouse TM3 cells transfected with pTA-8xGli-Luc reporter gene assessed as inhibition of 25 nM 3-chloro-4,7-difluo...More data for this Ligand-Target Pair