Reaction Details |
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Target | Protein-arginine deiminase type-1 |
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Ligand | BDBM50535202 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1929982 (CHEMBL4433158) |
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IC50 | 408000±n/a nM |
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Citation | Jamali, H; Khan, HA; Tjin, CC; Ellman, JA Cellular Activity of New Small Molecule Protein Arginine Deiminase 3 (PAD3) Inhibitors. ACS Med Chem Lett7:847-51 (2016) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Protein-arginine deiminase type-1 |
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Name: | Protein-arginine deiminase type-1 |
Synonyms: | PAD1 | PADI1 | PADI1_HUMAN | PDI1 | Peptidylarginine deiminase I | Protein-arginine deiminase type I |
Type: | PROTEIN |
Mol. Mass.: | 74664.17 |
Organism: | Homo sapiens (Human) |
Description: | ChEMBL_1290380 |
Residue: | 663 |
Sequence: | MAPKRVVQLSLKMPTHAVCVVGVEAHVDIHSDVPKGANSFRVSGSSGVEVFMVYNRTRVK
EPIGKARWPLDTDADMVVSVGTASKELKDFKVRVSYFGEQEDQALGRSVLYLTGVDISLE
VDTGRTGKVKRSQGDKKTWRWGPEGYGAILLVNCDRDNHRSAEPDLTHSWLMSLADLQDM
SPMLLSCNGPDKLFDSHKLVLNVPFSDSKRVRVFCARGGNSLSDYKQVLGPQCLSYEVER
QPGEQEIKFYVEGLTFPDADFLGLVSLSVSLVDPGTLPEVTLFTDTVGFRMAPWIMTPNT
QPPEELYVCRVMDTHGSNEKFLEDMSYLTLKANCKLTICPQVENRNDRWIQDEMEFGYIE
APHKSFPVVFDSPRNRGLKDFPYKRILGPDFGYVTREIPLPGPSSLDSFGNLDVSPPVTV
GGTEYPLGRILIGSSFPKSGGRQMARAVRNFLKAQQVQAPVELYSDWLSVGHVDEFLTFV
PTSDQKGFRLLLASPSACLKLFQEKKEEGYGEAAQFDGLKHQAKRSINEMLADRHLQRDN
LHAQKCIDWNRNVLKRELGLAESDIVDIPQLFFLKNFYAEAFFPDMVNMVVLGKYLGIPK
PYGPIINGRCCLEEKVQSLLEPLGLHCIFIDDYLSYHELQGEIHCGTNVRRKPFPFKWWN
MVP
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BDBM50535202 |
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n/a |
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Name | BDBM50535202 |
Synonyms: | CHEMBL4546087 |
Type | Small organic molecule |
Emp. Form. | C19H18ClN3O |
Mol. Mass. | 339.819 |
SMILES | ClCC(=N)NCC#CC(=O)NCc1cccc(c1)-c1ccccc1 |
Structure |
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