Reaction Details Report a problem with these data
Target
Stromelysin-3
Ligand
BDBM50362781
Substrate
n/a
Meas. Tech.
ChEMBL_2238066 (CHEMBL5151962)
IC50
4.5±n/a nM
Citation
Saha, D; Ryan, KR; Lakkaniga, NR; Acharya, B; Garcia, NG; Smith, EL; Frett, B Targeting Rearranged during Transfection in Cancer: A Perspective on Small-Molecule Inhibitors and Their Clinical Development. J Med Chem 64:11747-11773 (2021) [PubMed]
More Info.:
Target
Name:
Stromelysin-3
Synonyms:
MMP11_MOUSE | Matrix metalloproteinase 11 | Mmp11
Type:
PROTEIN
Mol. Mass.:
55452.62
Organism:
Mus musculus
Description:
ChEMBL_106453
Residue:
492
Sequence:
MARAACLLRAISRVLLLPLPLLLLLLLLLPSPLMARARPPESHRHHPVKKGPRLLHAALPNTLTSVPASHWVPSPAGSSRPLRCGVPDLPDVLNARNRQKRFVLSGGRWEKTDLTYRILRFPWQLVREQVRQTVAEALQVWSEVTPLTFTEVHEGRADIMIDFARYWHGDNLPFDGPGGILAHAFFPKTHREGDVHFDYDETWTIGDNQGTDLLQVAAHEFGHVLGLQHTTAAKALMSPFYTFRYPLSLSPDDRRGIQHLYGRPQMAPTSPAPTLSSQAGTDTNEIALLEPETPPDVCETSFDAVSTIRGELFFFKAGFVWRLRSGRLQPGYPALASRHWQGLPSPVDAAFEDAQGQIWFFQGAQYWVYDGEKPVLGPAPLSKLGLQGSPVHAALVWGPEKNKIYFFRGGDYWRFHPRTQRVDNPVPRRSTDWRGVPSEIDAAFQDAEGYAYFLRGHLYWKFDPVKVKVLEGFPRPVGPDFFDCAEPANTFR
Inhibitor
Name:
BDBM50362781
Synonyms:
1256580-46-7 | AF802 | Alecensa | Alectinib | CH5424802 | CHEMBL1738797 | US10851092, Example Alectinib | US11066363, Compound Alectinib | US9126931, 366
Type:
Small organic molecule
Emp. Form.:
C30H34N4O2
Mol. Mass.:
482.6166
SMILES:
CCc1cc2C(=O)c3c([nH]c4cc(ccc34)C#N)C(C)(C)c2cc1N1CCC(CC1)N1CCOCC1