BDBM6429 3-[(5-{5-[(3-chlorophenyl)amino]pyrimidin-2-yl}pyridin-3-yl)amino]propan-1-ol::3-[[5-[5-[(3-chlorophenyl)amino]-2-pyrimidinyl]-3-pyridinyl]amino]-1-propanol::pyrimidine-pyridine deriv.25
SMILES: OCCCNc1cncc(c1)-c1ncc(Nc2cccc(Cl)c2)cn1
InChI Key: InChIKey=JBKMFQCOYQUYDY-UHFFFAOYSA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
VEGFR-2 (KDR) (Rattus norvegicus (rat)) | BDBM6429 (3-[(5-{5-[(3-chlorophenyl)amino]pyrimidin-2-yl}pyr...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Johnson & Johnson Pharmaceutical | Assay Description The enzyme was assayed with a biotinylated peptide substrate and test compounds in the presence of 5 uM ATP/[gamma-33P]ATP in a streptavidin coated F... | J Med Chem 48: 1886-900 (2005) Article DOI: 10.1021/jm040099a BindingDB Entry DOI: 10.7270/Q2HM56NC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cyclin-Dependent Kinase 1 (CDK1) (Homo sapiens (Human)) | BDBM6429 (3-[(5-{5-[(3-chlorophenyl)amino]pyrimidin-2-yl}pyr...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | 8.0 | 30 |
Johnson & Johnson Pharmaceutical | Assay Description The enzyme was assayed with a biotinylated peptide substrate and test compounds in the presence of 5 uM ATP/[gamma-33P]ATP in a streptavidin coated F... | J Med Chem 48: 1886-900 (2005) Article DOI: 10.1021/jm040099a BindingDB Entry DOI: 10.7270/Q2HM56NC | |||||||||||
More data for this Ligand-Target Pair |