BDBM50256022 6-(5-((benzylamino)methyl)furan-2-yl)-N-(3-chloro-4-(3-fluorobenzyloxy)phenyl)thieno[2,3-d]pyrimidin-4-amine::CHEMBL519757
SMILES: Fc1cccc(COc2ccc(Nc3ncnc4sc(cc34)-c3ccc(CNCc4ccccc4)o3)cc2Cl)c1
InChI Key: InChIKey=KAJJGLKWPUKTKG-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50256022 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 |
Receptor tyrosine-protein kinase erbB-2
(Homo sapiens (Human)) | BDBM50256022
![PNG](/data/jpeg/tenK5025/BindingDB_50256022.png) (6-(5-((benzylamino)methyl)furan-2-yl)-N-(3-chloro-...)Show SMILES Fc1cccc(COc2ccc(Nc3ncnc4sc(cc34)-c3ccc(CNCc4ccccc4)o3)cc2Cl)c1 Show InChI InChI=1S/C31H24ClFN4O2S/c32-26-14-23(9-11-27(26)38-18-21-7-4-8-22(33)13-21)37-30-25-15-29(40-31(25)36-19-35-30)28-12-10-24(39-28)17-34-16-20-5-2-1-3-6-20/h1-15,19,34H,16-18H2,(H,35,36,37) | PDB MMDB
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 898 | 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 19: 817-20 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.011 BindingDB Entry DOI: 10.7270/Q2TH8NNN |
More data for this Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50256022
![PNG](/data/jpeg/tenK5025/BindingDB_50256022.png) (6-(5-((benzylamino)methyl)furan-2-yl)-N-(3-chloro-...)Show SMILES Fc1cccc(COc2ccc(Nc3ncnc4sc(cc34)-c3ccc(CNCc4ccccc4)o3)cc2Cl)c1 Show InChI InChI=1S/C31H24ClFN4O2S/c32-26-14-23(9-11-27(26)38-18-21-7-4-8-22(33)13-21)37-30-25-15-29(40-31(25)36-19-35-30)28-12-10-24(39-28)17-34-16-20-5-2-1-3-6-20/h1-15,19,34H,16-18H2,(H,35,36,37) | PDB MMDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline
Curated by ChEMBL
| Assay Description Inhibition of EGFR |
Bioorg Med Chem Lett 19: 817-20 (2009)
Article DOI: 10.1016/j.bmcl.2008.12.011 BindingDB Entry DOI: 10.7270/Q2TH8NNN |
More data for this Ligand-Target Pair | |