Reaction Details Report a problem with these data
Target
Disintegrin and metalloproteinase domain-containing protein 8
Ligand
BDBM50421690
Substrate
n/a
Meas. Tech.
ChEMBL_2269397
IC50
800±n/a nM
Citation
 Cuffaro, D; Camodeca, C; Tuccinardi, T; Ciccone, L; Bartsch, JW; Kellermann, T; Cook, L; Nuti, E; Rossello, A Discovery of Dimeric Arylsulfonamides as Potent ADAM8 Inhibitors. ACS Med Chem Lett 12:1787-1793 (2021) [PubMed] 
Target
Name:
Disintegrin and metalloproteinase domain-containing protein 8
Synonyms:
ADAM8 | ADAM8_HUMAN | MS2
Type:
PROTEIN
Mol. Mass.:
88789.34
Organism:
Human
Description:
ChEMBL_492660
Residue:
824
Sequence:
MRGLGLWLLGAMMLPAIAPSRPWALMEQYEVVLPWRLPGPRVRRALPSHLGLHPERVSYVLGATGHNFTLHLRKNRDLLGSGYTETYTAANGSEVTEQPRGQDHCFYQGHVEGYPDSAASLSTCAGLRGFFQVGSDLHLIEPLDEGGEGGRHAVYQAEHLLQTAGTCGVSDDSLGSLLGPRTAAVFRPRPGDSLPSRETRYVELYVVVDNAEFQMLGSEAAVRHRVLEVVNHVDKLYQKLNFRVVLVGLEIWNSQDRFHVSPDPSVTLENLLTWQARQRTRRHLHDNVQLITGVDFTGTTVGFARVSAMCSHSSGAVNQDHSKNPVGVACTMAHEMGHNLGMDHDENVQGCRCQERFEAGRCIMAGSIGSSFPRMFSDCSQAYLESFLERPQSVCLANAPDLSHLVGGPVCGNLFVERGEQCDCGPPEDCRNRCCNSTTCQLAEGAQCAHGTCCQECKVKPAGELCRPKKDMCDLEEFCDGRHPECPEDAFQENGTPCSGGYCYNGACPTLAQQCQAFWGPGGQAAEESCFSYDILPGCKASRYRADMCGVLQCKGGQQPLGRAICIVDVCHALTTEDGTAYEPVPEGTRCGPEKVCWKGRCQDLHVYRSSNCSAQCHNHGVCNHKQECHCHAGWAPPHCAKLLTEVHAASGSLPVFVVVVLVLLAVVLVTLAGIIVYRKARSRILSRNVAPKTTMGRSNPLFHQAASRVPAKGGAPAPSRGPQELVPTTHPGQPARHPASSVALKRPPPAPPVTVSSPPFPVPVYTRQAPKQVIKPTFAPPVPPVKPGAGAANPGPAEGAVGPKVALKPPIQRKQGAGAPTAP
  
Inhibitor
Name:
BDBM50421690
Synonyms:
CHEMBL5276957
Type:
Small organic molecule
Emp. Form.:
C37H40Br4N6O11S2
Mol. Mass.:
1128.493
SMILES:
ONC(=O)[C@@H](CCCNC(=O)NCCC[C@@H](NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1)C(=O)NO)NS(=O)(=O)c1ccc(OCc2cc(Br)cc(Br)c2)cc1 |r|
Structure:
Search PDB for entries with ligand similarity: