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Target
Cytochrome P450 3A5
Ligand
BDBM5445
Substrate
n/a
Meas. Tech.
ChEMBL_1491569 (CHEMBL3535031)
Ki
37600±n/a nM
Citation
 Chan, EC; New, LS; Chua, TB; Yap, CW; Ho, HK; Nelson, SD Interaction of lapatinib with cytochrome P450 3A5. Drug Metab Dispos 40:1414-22 (2012) [PubMed]  Article 
Target
Name:
Cytochrome P450 3A5
Synonyms:
Cytochrome P450 3A5 | CP3A5_HUMAN | CYP3A5 | Cytochrome P450 3A5 (CYP3A5)
Type:
Protein
Mol. Mass.:
57118.00
Organism:
Human
Description:
P20815
Residue:
502
Sequence:
MDLIPNLAVETWLLLAVSLVLLYLYGTRTHGLFKRLGIPGPTPLPLLGNVLSYRQGLWKFDTECYKKYGKMWGTYEGQLPVLAITDPDVIRTVLVKECYSVFTNRRSLGPVGFMKSAISLAEDEEWKRIRSLLSPTFTSGKLKEMFPIIAQYGDVLVRNLRREAEKGKPVTLKDIFGAYSMDVITGTSFGVNIDSLNNPQDPFVESTKKFLKFGFLDPLFLSIILFPFLTPVFEALNVSLFPKDTINFLSKSVNRMKKSRLNDKQKHRLDFLQLMIDSQNSKETESHKALSDLELAAQSIIFIFAGYETTSSVLSFTLYELATHPDVQQKLQKEIDAVLPNKAPPTYDAVVQMEYLDMVVNETLRLFPVAIRLERTCKKDVEINGVFIPKGSMVVIPTYALHHDPKYWTEPEEFRPERFSKKKDSIDPYIYTPFGTGPRNCIGMRFALMNMKLALIRVLQNFSFKPCKETQIPLKLDTQGLLQPEKPIVLKVDSRDGTLSGE
  
Inhibitor
Name:
BDBM5445
Synonyms:
N-{3-chloro-4-[(3-fluorophenyl)methoxy]phenyl}-6-(5-{[(2-methanesulfonylethyl)amino]methyl}furan-2-yl)quinazolin-4-amine | cid_208908 | CHEMBL554 | Lapatinib | N-{3-chloro-4-[(3-fluoro-benzyl)oxy]phenyl}-6-[5-({2-(methylsulfonyl)ethyl]amino}methyl)-2-furyl]-4-quinazolinamine | LAPATINIB DITOSYLATE | GW572016 | Tykerb | US9730934, Lapatinib ditosylate | US10507209, Compound Lapatinib | US10822334, Compound Lapatinib
Type:
Small organic molecule
Emp. Form.:
C29H26ClFN4O4S
Mol. Mass.:
580.13
SMILES:
CS(=O)(=O)CCNCc1ccc(o1)-c1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1
Structure:
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