Reaction Details |
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Target | Bifunctional epoxide hydrolase 2 |
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Ligand | BDBM50274270 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1713978 (CHEMBL4124027) |
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IC50 | 5334±n/a nM |
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Citation | Burmistrov, V; Morisseau, C; Pitushkin, D; Karlov, D; Fayzullin, RR; Butov, GM; Hammock, BD Adamantyl thioureas as soluble epoxide hydrolase inhibitors. Bioorg Med Chem Lett28:2302-2313 (2018) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Bifunctional epoxide hydrolase 2 |
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Name: | Bifunctional epoxide hydrolase 2 |
Synonyms: | Cytosolic epoxide hydrolase 2 | EBifunctional epoxide hydrolase 2 | EPHX2 | Epoxide hydratase | HYES_HUMAN | Lipid-phosphate phosphatase | Soluble epoxide hydrolase (sEH) | epoxide hydrolase 2, cytoplasmic |
Type: | Enzyme |
Mol. Mass.: | 62613.07 |
Organism: | Homo sapiens (Human) |
Description: | P34913 |
Residue: | 555 |
Sequence: | MTLRAAVFDLDGVLALPAVFGVLGRTEEALALPRGLLNDAFQKGGPEGATTRLMKGEITL
SQWIPLMEENCRKCSETAKVCLPKNFSIKEIFDKAISARKINRPMLQAALMLRKKGFTTA
ILTNTWLDDRAERDGLAQLMCELKMHFDFLIESCQVGMVKPEPQIYKFLLDTLKASPSEV
VFLDDIGANLKPARDLGMVTILVQDTDTALKELEKVTGIQLLNTPAPLPTSCNPSDMSHG
YVTVKPRVRLHFVELGSGPAVCLCHGFPESWYSWRYQIPALAQAGYRVLAMDMKGYGESS
APPEIEEYCMEVLCKEMVTFLDKLGLSQAVFIGHDWGGMLVWYMALFYPERVRAVASLNT
PFIPANPNMSPLESIKANPVFDYQLYFQEPGVAEAELEQNLSRTFKSLFRASDESVLSMH
KVCEAGGLFVNSPEEPSLSRMVTEEEIQFYVQQFKKSGFRGPLNWYRNMERNWKWACKSL
GRKILIPALMVTAEKDFVLVPQMSQHMEDWIPHLKRGHIEDCGHWTQMDKPTEVNQILIK
WLDSDARNPPVVSKM
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BDBM50274270 |
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n/a |
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Name | BDBM50274270 |
Synonyms: | CHEMBL4128446 |
Type | Small organic molecule |
Emp. Form. | C29H40N2S |
Mol. Mass. | 448.706 |
SMILES | S=C(NCCC12CC3CC(CC(C3)C1)C2)Nc1ccc(cc1)C12CC3CC(CC(C3)C1)C2 |TLB:4:5:8:12.11.10,19:22:25:29.28.27,THB:13:5:8:12.11.10,13:11:8:14.6.5,23:22:25.24.29:27,23:24:27:31.22.30,30:22:25:29.28.27,30:28:25:31.22.23,6:7:10:14.5.13,6:5:8.7.12:10| |
Structure |
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