| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Protein-arginine deiminase type-4 |
|---|
| Ligand | BDBM646129 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | In Vitro PAD4 BAEE Biochemical Assay |
|---|
| IC50 | 34.5±n/a nM |
|---|
| Citation |  Byun, DH; Cai, ZR; Canales, EY; Debien, LP; Hansen, TR; Huang, R; Jansa, P; Lee, RA; Loyer-Drew, JA; McFadden, R; Mitchell, ML; Pyun, H; Saito, RD; Sangi, MS; Schrier, AJ; Shatskikh, ME; Taylor, JG; Van Veldhuizen, JJ; Xu, L Inhibitors of peptidylarginine deiminases US Patent US11878965 Publication Date 1/23/2024 |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Protein-arginine deiminase type-4 |
|---|
| 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: | MAQGTLIRVTPEQPTHAVCVLGTLTQLDICSSAPEDCTSFSINASPGVVVDIAHGPPAKK
KSTGSSTWPLDPGVEVTLTMKVASGSTGDQKVQISYYGPKTPPVKALLYLTGVEISLCAD
ITRTGKVKPTRAVKDQRTWTWGPCGQGAILLVNCDRDNLESSAMDCEDDEVLDSEDLQDM
SLMTLSTKTPKDFFTNHTLVLHVARSEMDKVRVFQATRGKLSSKCSVVLGPKWPSHYLMV
PGGKHNMDFYVEALAFPDTDFPGLITLTISLLDTSNLELPEAVVFQDSVVFRVAPWIMTP
NTQPPQEVYACSIFENEDFLKSVTTLAMKAKCKLTICPEEENMDDQWMQDEMEIGYIQAP
HKTLPVVFDSPRNRGLKEFPIKRVMGPDFGYVTRGPQTGGISGLDSFGNLEVSPPVTVRG
KEYPLGRILFGDSCYPSNDSRQMHQALQDFLSAQQVQAPVKLYSDWLSVGHVDEFLSFVP
APDRKGFRLLLASPRSCYKLFQEQQNEGHGEALLFEGIKKKKQQKIKNILSNKTLREHNS
FVERCIDWNRELLKRELGLAESDIIDIPQLFKLKEFSKAEAFFPNMVNMLVLGKHLGIPK
PFGPVINGRCCLEEKVCSLLEPLGLQCTFINDFFTYHIRHGEVHCGTNVRRKPFSFKWWN
MVP
|
|
|
|---|
| BDBM646129 |
|---|
| n/a |
|---|
| Name | BDBM646129 |
|---|
| Synonyms: | US11878965, Example 114 | methyl (2-(5-((1R,2R,4S)-2- amino-7-azabicyclo[2.2.1] heptane-7- carbonyl)-7-methoxy-1-methyl- 1H-benzo[d]imidazol-2-yl)-1- (cyclopropylmethyl)-1H-indol-6- yl)(methyl)carbamate |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C31H36N6O4 |
|---|
| Mol. Mass. | 556.6553 |
|---|
| SMILES | COC(=O)N(C)c1ccc2cc(-c3nc4cc(cc(OC)c4n3C)C(=O)N3[C@H]4CC[C@@H]3[C@H](N)C4)n(CC3CC3)c2c1 |r,THB:24:26:31.33:29.28| |
|---|
| Structure | 
|
|---|
Search and Browse
