BDBM50296949 (2Z)-5-(4-chlorophenyl)-3-phenylpent-2-enoic acid::(Z)-5-(4-Chlorophenyl)-3-phenylpent-2-enoicAcid::(Z)-5-(4-chlorophenyl)-3-phenylpent-2-enoic acid::CHEMBL539134::PS48
SMILES: OC(=O)\C=C(\CCc1ccc(Cl)cc1)c1ccccc1
InChI Key: InChIKey=LLJYFDRQFPQGNY-QINSGFPZSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human)) | BDBM50296949![]() ((2Z)-5-(4-chlorophenyl)-3-phenylpent-2-enoic acid ...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars | MMDB PDB Article PubMed | n/a | n/a | 9.70E+4 | n/a | n/a | n/a | n/a | 7.4 | 0 |
Universit£tsklinikum Frankfurt | Assay Description The AlphaScreen Assay (Perkin Elmer) was performed according to the manufacturer's protocol in 384-well microtiter plates. Incubations were performe... | ACS Chem Biol 8: 2283-92 (2013) Article DOI: 10.1021/cb400452z BindingDB Entry DOI: 10.7270/Q2N878F2 | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) | ||||||||||||
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human)) | BDBM50296949![]() ((2Z)-5-(4-chlorophenyl)-3-phenylpent-2-enoic acid ...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars | MMDB PDB PubMed | n/a | n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a |
Universit£tsklinikum Frankfurt Curated by ChEMBL | Assay Description Binding affinity to human PDPK1 Y288G/Q292A mutant expressed in insect cell system assessed as substrate phosphorylation by isothermal titration calo... | Nat Chem Biol 5: 758-64 (2009) BindingDB Entry DOI: 10.7270/Q2V98BXR | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) | ||||||||||||
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human)) | BDBM50296949![]() ((2Z)-5-(4-chlorophenyl)-3-phenylpent-2-enoic acid ...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars | MMDB PDB Article PubMed | n/a | n/a | n/a | 1.03E+4 | n/a | n/a | n/a | n/a | n/a |
Saarland University Curated by ChEMBL | Assay Description Binding affinity to PDK1 (50 to 359) by isothermal titration calorimetry | J Med Chem 52: 4683-93 (2009) Article DOI: 10.1021/jm9001499 BindingDB Entry DOI: 10.7270/Q2FB52ZC | |||||||||||
More data for this Ligand-Target Pair | ![]() 3D Structure (crystal) |