Reaction Details Report a problem with these data
Target
Protein-arginine deiminase type-4
Ligand
BDBM50029770
Substrate
n/a
Meas. Tech.
ChEMBL_468732 (CHEMBL929914)
IC50
>10000000±n/a nM
Citation
 Knuckley, B; Luo, Y; Thompson, PR Profiling Protein Arginine Deiminase 4 (PAD4): a novel screen to identify PAD4 inhibitors. Bioorg Med Chem 16:739-45 (2008) [PubMed]  Article 
Target
Name:
Protein-arginine deiminase type-4
Synonyms:
PAD4 | PADI4 | PADI4_HUMAN | PADI5 | PDI5
Type:
Enzyme Catalytic Domain
Mol. Mass.:
74078.90
Organism:
Homo sapiens (Human)
Description:
gi_216548487
Residue:
663
Sequence:
MAQGTLIRVTPEQPTHAVCVLGTLTQLDICSSAPEDCTSFSINASPGVVVDIAHGPPAKKKSTGSSTWPLDPGVEVTLTMKVASGSTGDQKVQISYYGPKTPPVKALLYLTGVEISLCADITRTGKVKPTRAVKDQRTWTWGPCGQGAILLVNCDRDNLESSAMDCEDDEVLDSEDLQDMSLMTLSTKTPKDFFTNHTLVLHVARSEMDKVRVFQATRGKLSSKCSVVLGPKWPSHYLMVPGGKHNMDFYVEALAFPDTDFPGLITLTISLLDTSNLELPEAVVFQDSVVFRVAPWIMTPNTQPPQEVYACSIFENEDFLKSVTTLAMKAKCKLTICPEEENMDDQWMQDEMEIGYIQAPHKTLPVVFDSPRNRGLKEFPIKRVMGPDFGYVTRGPQTGGISGLDSFGNLEVSPPVTVRGKEYPLGRILFGDSCYPSNDSRQMHQALQDFLSAQQVQAPVKLYSDWLSVGHVDEFLSFVPAPDRKGFRLLLASPRSCYKLFQEQQNEGHGEALLFEGIKKKKQQKIKNILSNKTLREHNSFVERCIDWNRELLKRELGLAESDIIDIPQLFKLKEFSKAEAFFPNMVNMLVLGKHLGIPKPFGPVINGRCCLEEKVCSLLEPLGLQCTFINDFFTYHIRHGEVHCGTNVRRKPFSFKWWNMVP
  
Inhibitor
Name:
BDBM50029770
Synonyms:
4-amino-N-(5-methyl-isoxazol-3-yl)-benzenesulfonamide | 4-amino-N-(5-methylisoxazol-3-yl)benzenesulfonamide | ACETYLSULFAMETHOXAZOLE | BACTRIM | CHEMBL443 | COTRIM | GANTANOL | GANTANOL-DS | RO 4-2130 | SEPTRA | SULFAMETHOPRIM | SULFAMETHOPRIM-DS | SULFAMETHOXAZOLE SODIUM | SULFATRIM | SULFATRIM-DS | SULFATRIM-SS | SULMEPRIM | SULPHAMETHOXAZOLE | TRIMETH/SULFA | UROBAK
Type:
Small organic molecule
Emp. Form.:
C10H11N3O3S
Mol. Mass.:
253.278
SMILES:
Cc1cc(NS(=O)(=O)c2ccc(N)cc2)no1
Structure:
Search PDB for entries with ligand similarity: