BDBM50307787 (R)-N-Hydroxy-7-(7-methoxy-4-(1-phenylethylamino)quinazolin-6-yloxy)heptanamide::CHEMBL605976
SMILES: COc1cc2ncnc(N[C@H](C)c3ccccc3)c2cc1OCCCCCCC(=O)NO
InChI Key: InChIKey=VPPDBLLRRNCUSU-QGZVFWFLSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50307787 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)) | BDBM50307787
((R)-N-Hydroxy-7-(7-methoxy-4-(1-phenylethylamino)q...)Show SMILES COc1cc2ncnc(N[C@H](C)c3ccccc3)c2cc1OCCCCCCC(=O)NO |r| Show InChI InChI=1S/C24H30N4O4/c1-17(18-10-6-5-7-11-18)27-24-19-14-22(21(31-2)15-20(19)25-16-26-24)32-13-9-4-3-8-12-23(29)28-30/h5-7,10-11,14-17,30H,3-4,8-9,12-13H2,1-2H3,(H,28,29)(H,25,26,27)/t17-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Curis Inc
Curated by ChEMBL
| Assay Description
Inhibition of HER2 |
J Med Chem 53: 2000-9 (2010)
Article DOI: 10.1021/jm901453q
BindingDB Entry DOI: 10.7270/Q2CR5TGQ |
More data for this
Ligand-Target Pair | |
Epidermal growth factor receptor
(Homo sapiens (Human)) | BDBM50307787
((R)-N-Hydroxy-7-(7-methoxy-4-(1-phenylethylamino)q...)Show SMILES COc1cc2ncnc(N[C@H](C)c3ccccc3)c2cc1OCCCCCCC(=O)NO |r| Show InChI InChI=1S/C24H30N4O4/c1-17(18-10-6-5-7-11-18)27-24-19-14-22(21(31-2)15-20(19)25-16-26-24)32-13-9-4-3-8-12-23(29)28-30/h5-7,10-11,14-17,30H,3-4,8-9,12-13H2,1-2H3,(H,28,29)(H,25,26,27)/t17-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
Curis Inc
Curated by ChEMBL
| Assay Description
Inhibition of EGFR |
J Med Chem 53: 2000-9 (2010)
Article DOI: 10.1021/jm901453q
BindingDB Entry DOI: 10.7270/Q2CR5TGQ |
More data for this
Ligand-Target Pair | |
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