| Reaction Details |
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 | Report a problem with these data |
| Target | Thioredoxin reductase 3 |
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| Ligand | BDBM50384998 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1473858 (CHEMBL3418935) |
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| IC50 | >40000±n/a nM |
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| Citation |  Zhang, B; Duan, D; Ge, C; Yao, J; Liu, Y; Li, X; Fang, J Synthesis of xanthohumol analogues and discovery of potent thioredoxin reductase inhibitor as potential anticancer agent. J Med Chem58:1795-805 (2015) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Thioredoxin reductase 3 |
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| Name: | Thioredoxin reductase 3 |
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| Synonyms: | TGR | TGR | TRXR3 | TRXR3_HUMAN | TXNRD3 | Thioredoxin and glutathione reductase | Thioredoxin reductase 3 | Thioredoxin reductase TR2 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 70543.23 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_104858 |
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| Residue: | 642 |
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| Sequence: | MERSPPQSPGPGKAGDAPNRRSGHVRGARVLSPPGRRARLSSPGPSRSSEAREELRRHLV
GLIERSRVVIFSKSYCPHSTRVKELFSSLGVECNVLELDQVDDGARVQEVLSEITNQKTV
PNIFVNKVHVGGCDQTFQAYQSGLLQKLLQEDLAYDYDLIIIGGGSGGLSCAKEAAILGK
KVMVLDFVVPSPQGTSWGLGGTCVNVGCIPKKLMHQAALLGQALCDSRKFGWEYNQQVRH
NWETMTKAIQNHISSLNWGYRLSLREKAVAYVNSYGEFVEHHKIKATNKKGQETYYTAAQ
FVIATGERPRYLGIQGDKEYCITSDDLFSLPYCPGKTLVVGASYVALECAGFLAGFGLDV
TVMVRSILLRGFDQEMAEKVGSYMEQHGVKFLRKFIPVMVQQLEKGSPGKLKVLAKSTEG
TETIEGVYNTVLLAIGRDSCTRKIGLEKIGVKINEKSGKIPVNDVEQTNVPYVYAVGDIL
EDKPELTPVAIQSGKLLAQRLFGASLEKCDYINVPTTVFTPLEYGCCGLSEEKAIEVYKK
ENLEIYHTLFWPLEWTVAGRENNTCYAKIICNKFDHDRVIGFHILGPNAGEVTQGFAAAM
KCGLTKQLLDDTIGIHPTCGEVFTTLEITKSSGLDITQKGCG
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| BDBM50384998 |
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| n/a |
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| Name | BDBM50384998 |
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| Synonyms: | CVD-0019905 | XANTHOHUMOL |
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| Type | Small organic molecule |
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| Emp. Form. | C21H22O5 |
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| Mol. Mass. | 354.3964 |
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| SMILES | [#6]-[#8]-c1cc(-[#8])c(-[#6]\[#6]=[#6](/[#6])-[#6])c(-[#8])c1-[#6](=O)\[#6]=[#6]\c1ccc(-[#8])cc1 |
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| Structure | 
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