Found 2 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 |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50189122
(CHEMBL377250 | [4-(3-fluoro-benzyloxy)-3-trifluoro...)Show SMILES Fc1cccc(COc2ccc(Nc3ncnc4ccc(cc34)-c3ccc(CN4CCS(=O)CC4)o3)cc2C(F)(F)F)c1 Show InChI InChI=1S/C31H26F4N4O3S/c32-22-3-1-2-20(14-22)18-41-29-8-5-23(16-26(29)31(33,34)35)38-30-25-15-21(4-7-27(25)36-19-37-30)28-9-6-24(42-28)17-39-10-12-43(40)13-11-39/h1-9,14-16,19H,10-13,17-18H2,(H,36,37,38) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 89 | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline
Curated by ChEMBL
| Assay Description Inhibition of ErbB1 |
Bioorg Med Chem Lett 16: 4686-91 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.090 BindingDB Entry DOI: 10.7270/Q2VM4D2Z |
More data for this Ligand-Target Pair | |
Receptor tyrosine-protein kinase erbB-2
(Homo sapiens (Human)) | BDBM50189122
(CHEMBL377250 | [4-(3-fluoro-benzyloxy)-3-trifluoro...)Show SMILES Fc1cccc(COc2ccc(Nc3ncnc4ccc(cc34)-c3ccc(CN4CCS(=O)CC4)o3)cc2C(F)(F)F)c1 Show InChI InChI=1S/C31H26F4N4O3S/c32-22-3-1-2-20(14-22)18-41-29-8-5-23(16-26(29)31(33,34)35)38-30-25-15-21(4-7-27(25)36-19-37-30)28-9-6-24(42-28)17-39-10-12-43(40)13-11-39/h1-9,14-16,19H,10-13,17-18H2,(H,36,37,38) | PDB MMDB
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 141 | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline
Curated by ChEMBL
| Assay Description Inhibition of ErbB2 |
Bioorg Med Chem Lett 16: 4686-91 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.090 BindingDB Entry DOI: 10.7270/Q2VM4D2Z |
More data for this Ligand-Target Pair | |