Found 4 hits Enzyme Inhibition Constant Data Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Kinesin-like protein KIF11
(367/367 = 100%)† (Homo sapiens (Human)) | BDBM50260279
((R)-(4-(3-hydroxyphenyl)-1,6-dimethyl-2-thioxo-1,2...)Show SMILES CN1C(=S)N[C@@H](C(C(=O)c2ccccc2)=C1C)c1cccc(O)c1 |r,c:15| Show InChI InChI=1S/C19H18N2O2S/c1-12-16(18(23)13-7-4-3-5-8-13)17(20-19(24)21(12)2)14-9-6-10-15(22)11-14/h3-11,17,22H,1-2H3,(H,20,24)/t17-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| DrugBank MMDB PDB Article PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
CNRS-Commissariat à l'Energie Atomique-Université Joseph Fourier
Curated by ChEMBL
| Assay Description Inhibition of basal ATPase activity of human Eg5 |
J Biol Chem 282: 9740-7 (2007)
Article DOI: 10.1074/jbc.M608883200 BindingDB Entry DOI: 10.7270/Q2K64HVW |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11
(367/367 = 100%)† (Homo sapiens (Human)) | BDBM50260279
((R)-(4-(3-hydroxyphenyl)-1,6-dimethyl-2-thioxo-1,2...)Show SMILES CN1C(=S)N[C@@H](C(C(=O)c2ccccc2)=C1C)c1cccc(O)c1 |r,c:15| Show InChI InChI=1S/C19H18N2O2S/c1-12-16(18(23)13-7-4-3-5-8-13)17(20-19(24)21(12)2)14-9-6-10-15(22)11-14/h3-11,17,22H,1-2H3,(H,20,24)/t17-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| DrugBank MMDB PDB Article PubMed
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | n/a | n/a |
Cairo University
Curated by ChEMBL
| Assay Description Inhibition of Eg5 basal ATPase activity (unknown origin) |
Eur J Med Chem 62: 614-31 (2013)
Article DOI: 10.1016/j.ejmech.2013.01.031 BindingDB Entry DOI: 10.7270/Q2KH0PP9 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11
(367/367 = 100%)† (Homo sapiens (Human)) | BDBM50260279
((R)-(4-(3-hydroxyphenyl)-1,6-dimethyl-2-thioxo-1,2...)Show SMILES CN1C(=S)N[C@@H](C(C(=O)c2ccccc2)=C1C)c1cccc(O)c1 |r,c:15| Show InChI InChI=1S/C19H18N2O2S/c1-12-16(18(23)13-7-4-3-5-8-13)17(20-19(24)21(12)2)14-9-6-10-15(22)11-14/h3-11,17,22H,1-2H3,(H,20,24)/t17-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| DrugBank MMDB PDB Article PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
Cairo University
Curated by ChEMBL
| Assay Description Inhibition of Eg5 assessed as inhibition of microtubule-induced ATPase activity (unknown origin) |
Eur J Med Chem 62: 614-31 (2013)
Article DOI: 10.1016/j.ejmech.2013.01.031 BindingDB Entry DOI: 10.7270/Q2KH0PP9 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Kinesin-like protein KIF11
(367/367 = 100%)† (Homo sapiens (Human)) | BDBM50260279
((R)-(4-(3-hydroxyphenyl)-1,6-dimethyl-2-thioxo-1,2...)Show SMILES CN1C(=S)N[C@@H](C(C(=O)c2ccccc2)=C1C)c1cccc(O)c1 |r,c:15| Show InChI InChI=1S/C19H18N2O2S/c1-12-16(18(23)13-7-4-3-5-8-13)17(20-19(24)21(12)2)14-9-6-10-15(22)11-14/h3-11,17,22H,1-2H3,(H,20,24)/t17-/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem
Similars
| DrugBank MMDB PDB Article PubMed
| n/a | n/a | 150 | n/a | n/a | n/a | n/a | n/a | n/a |
CNRS-Commissariat à l'Energie Atomique-Université Joseph Fourier
Curated by ChEMBL
| Assay Description Inhibition of microtubule-stimulated human Eg5 ATPase activity |
J Biol Chem 282: 9740-7 (2007)
Article DOI: 10.1074/jbc.M608883200 BindingDB Entry DOI: 10.7270/Q2K64HVW |
More data for this Ligand-Target Pair | 3D Structure (crystal) |