Found 3 hits in this display 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 |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50321738
(2-Amino-6-[(2-oxo-2-phenylethyl)sulfanyl]-4-(3-thi...)Show SMILES Nc1nc(SCC(=O)c2ccccc2)c(C#N)c(-c2ccsc2)c1C#N Show InChI InChI=1S/C19H12N4OS2/c20-8-14-17(13-6-7-25-10-13)15(9-21)19(23-18(14)22)26-11-16(24)12-4-2-1-3-5-12/h1-7,10H,11H2,(H2,22,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description Inhibition of human recombinant histidine-tagged ABL (230-517) expressed in Sf9 cells by ELISA |
Eur J Med Chem 45: 2919-27 (2010)
Article DOI: 10.1016/j.ejmech.2010.03.017 BindingDB Entry DOI: 10.7270/Q25X294R |
More data for this Ligand-Target Pair | |
ALK tyrosine kinase receptor
(Homo sapiens (Human)) | BDBM50321738
(2-Amino-6-[(2-oxo-2-phenylethyl)sulfanyl]-4-(3-thi...)Show SMILES Nc1nc(SCC(=O)c2ccccc2)c(C#N)c(-c2ccsc2)c1C#N Show InChI InChI=1S/C19H12N4OS2/c20-8-14-17(13-6-7-25-10-13)15(9-21)19(23-18(14)22)26-11-16(24)12-4-2-1-3-5-12/h1-7,10H,11H2,(H2,22,23) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description Inhibition of human recombinant histidine-tagged ALK (103-1459) expressed in Sf9 cells by ELISA |
Eur J Med Chem 45: 2919-27 (2010)
Article DOI: 10.1016/j.ejmech.2010.03.017 BindingDB Entry DOI: 10.7270/Q25X294R |
More data for this Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM50321738
(2-Amino-6-[(2-oxo-2-phenylethyl)sulfanyl]-4-(3-thi...)Show SMILES Nc1nc(SCC(=O)c2ccccc2)c(C#N)c(-c2ccsc2)c1C#N Show InChI InChI=1S/C19H12N4OS2/c20-8-14-17(13-6-7-25-10-13)15(9-21)19(23-18(14)22)26-11-16(24)12-4-2-1-3-5-12/h1-7,10H,11H2,(H2,22,23) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Technische Universit£t Braunschweig
Curated by ChEMBL
| Assay Description Inhibition of human recombinant histidine-tagged RET (700-1020) expressed in Sf9 cells by ELISA |
Eur J Med Chem 45: 2919-27 (2010)
Article DOI: 10.1016/j.ejmech.2010.03.017 BindingDB Entry DOI: 10.7270/Q25X294R |
More data for this Ligand-Target Pair | |