BDBM6436 3-[(5-{6-[(3-chlorophenyl)amino]pyrazin-2-yl}-1,3-thiazol-2-yl)amino]propan-1-ol::3-{[5-[6-((3-Chlorophenyl)amino)pyrazin-2-yl]thiazol-2-yl]amino}propan-1-ol::pyrazine-thiazol deriv.59
SMILES: OCCCNc1ncc(s1)-c1cncc(Nc2cccc(Cl)c2)n1
InChI Key: InChIKey=UJWGPYCAVBVVHJ-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)) | BDBM6436 (3-[(5-{6-[(3-chlorophenyl)amino]pyrazin-2-yl}-1,3-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 708 | 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)) | BDBM6436 (3-[(5-{6-[(3-chlorophenyl)amino]pyrazin-2-yl}-1,3-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Patents | Article PubMed | n/a | n/a | 8.08E+3 | 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 |