Found 3 hits for monomerid = 50232578 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)) | BDBM50232578
(CHEMBL4066163)Show SMILES CC[C@H]1N(C2CCCC2)c2nc(Nc3cc(F)c(cc3OC)C(=O)NC3CCN(C)CC3)ncc2-n2cnc(C#N)c12 |r| Show InChI InChI=1S/C30H36FN9O2/c1-4-24-27-23(15-32)34-17-39(27)25-16-33-30(37-28(25)40(24)19-7-5-6-8-19)36-22-14-21(31)20(13-26(22)42-3)29(41)35-18-9-11-38(2)12-10-18/h13-14,16-19,24H,4-12H2,1-3H3,(H,35,41)(H,33,36,37)/t24-/m1/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda California
Curated by ChEMBL
| Assay Description Inhibition of human FLAG-tagged PLK1 expressed in baculovirus infected sf21 cells using Biotin-AGAGTVPESIHSFIGDGLV as substrate by TR-FRET assay |
Bioorg Med Chem Lett 27: 1311-1315 (2017)
BindingDB Entry DOI: 10.7270/Q2K939RQ |
More data for this Ligand-Target Pair | |
Cytochrome P450 2C8
(Homo sapiens (Human)) | BDBM50232578
(CHEMBL4066163)Show SMILES CC[C@H]1N(C2CCCC2)c2nc(Nc3cc(F)c(cc3OC)C(=O)NC3CCN(C)CC3)ncc2-n2cnc(C#N)c12 |r| Show InChI InChI=1S/C30H36FN9O2/c1-4-24-27-23(15-32)34-17-39(27)25-16-33-30(37-28(25)40(24)19-7-5-6-8-19)36-22-14-21(31)20(13-26(22)42-3)29(41)35-18-9-11-38(2)12-10-18/h13-14,16-19,24H,4-12H2,1-3H3,(H,35,41)(H,33,36,37)/t24-/m1/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda California
Curated by ChEMBL
| Assay Description Inhibition of CYP2C8 (unknown origin) |
Bioorg Med Chem Lett 27: 1311-1315 (2017)
BindingDB Entry DOI: 10.7270/Q2K939RQ |
More data for this Ligand-Target Pair | |
Cytochrome P450 3A4
(Homo sapiens (Human)) | BDBM50232578
(CHEMBL4066163)Show SMILES CC[C@H]1N(C2CCCC2)c2nc(Nc3cc(F)c(cc3OC)C(=O)NC3CCN(C)CC3)ncc2-n2cnc(C#N)c12 |r| Show InChI InChI=1S/C30H36FN9O2/c1-4-24-27-23(15-32)34-17-39(27)25-16-33-30(37-28(25)40(24)19-7-5-6-8-19)36-22-14-21(31)20(13-26(22)42-3)29(41)35-18-9-11-38(2)12-10-18/h13-14,16-19,24H,4-12H2,1-3H3,(H,35,41)(H,33,36,37)/t24-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Takeda California
Curated by ChEMBL
| Assay Description Inhibition of CYP3A4 (unknown origin) |
Bioorg Med Chem Lett 27: 1311-1315 (2017)
BindingDB Entry DOI: 10.7270/Q2K939RQ |
More data for this Ligand-Target Pair | |