BDBM41768 MLS000040805::N-[(2-oxidanylidene-1H-quinolin-3-yl)methyl]-N-propan-2-yl-pyridine-3-carboxamide::N-[(2-oxo-1H-quinolin-3-yl)methyl]-N-propan-2-yl-3-pyridinecarboxamide::N-[(2-oxo-1H-quinolin-3-yl)methyl]-N-propan-2-ylpyridine-3-carboxamide::N-isopropyl-N-[(2-keto-1H-quinolin-3-yl)methyl]nicotinamide::SMR000045745::cid_664836
SMILES: CC(C)N(Cc1cc2ccccc2[nH]c1=O)C(=O)c1cccnc1
InChI Key: InChIKey=YRUNVDQFBNTJJU-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Serine/threonine-protein kinase PLK1 (Homo sapiens (Human)) | BDBM41768 (MLS000040805 | N-[(2-oxidanylidene-1H-quinolin-3-y...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay | Assay Description List of compounds to be tested: Compounds that met the active criterion of Z-score is = -3 in the in vitro PLK1-PBD binding primary screen AID 693,... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2Z036KJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serine/threonine-protein kinase PLK1 (Homo sapiens (Human)) | BDBM41768 (MLS000040805 | N-[(2-oxidanylidene-1H-quinolin-3-y...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a |
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay | Assay Description List of compounds to be tested: Compounds that met the active criterion of Z-score is = -3 in the in vitro PLK1-PBD binding primary screen AID 693,... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2N58JS6 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Serine/threonine-protein kinase PLK1 (Homo sapiens (Human)) | BDBM41768 (MLS000040805 | N-[(2-oxidanylidene-1H-quinolin-3-y...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | >5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Pittsburgh Molecular Library Screening Center Curated by PubChem BioAssay | Assay Description List of compounds to be tested: Compounds that met the active criterion of Z-score is = -3 in the in vitro PLK1-PBD binding primary screen AID 693,... | PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2T72FVT | |||||||||||
More data for this Ligand-Target Pair |