| Reaction Details |
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 | Report a problem with these data |
| Target | Squalene--hopene cyclase |
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| Ligand | BDBM50143433 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_201951 |
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| IC50 | 100000±n/a nM |
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| Citation |  Cravotto, G; Balliano, G; Robaldo, B; Oliaro-Bosso, S; Chimichi, S; Boccalini, M Farnesyloxycoumarins, a new class of squalene-hopene cyclase inhibitors. Bioorg Med Chem Lett14:1931-4 (2004) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Squalene--hopene cyclase |
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| Name: | Squalene--hopene cyclase |
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| Synonyms: | SQHC_ALIAD | Squalene--hopene cyclase | Squalene-hopene cyclase | shc |
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| Type: | PROTEIN |
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| Mol. Mass.: | 71559.28 |
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| Organism: | Alicyclobacillus acidocaldarius |
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| Description: | ChEMBL_201951 |
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| Residue: | 631 |
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| Sequence: | MAEQLVEAPAYARTLDRAVEYLLSCQKDEGYWWGPLLSNVTMEAEYVLLCHILDRVDRDR
MEKIRRYLLHEQREDGTWALYPGGPPDLDTTIEAYVALKYIGMSRDEEPMQKALRFIQSQ
GGIESSRVFTRMWLALVGEYPWEKVPMVPPEIMFLGKRMPLNIYEFGSWARATVVALSIV
MSRQPVFPLPERARVPELYETDVPPRRRGAKGGGGWIFDALDRALHGYQKLSVHPFRRAA
EIRALDWLLERQAGDGSWGGIQPPWFYALIALKILDMTQHPAFIKGWEGLELYGVELDYG
GWMFQASISPVWDTGLAVLALRAAGLPADHDRLVKAGEWLLDRQITVPGDWAVKRPNLKP
GGFAFQFDNVYYPDVDDTAVVVWALNTLRLPDERRRRDAMTKGFRWIVGMQSSNGGWGAY
DVDNTSDLPNHIPFCDFGEVTDPPSEDVTAHVLECFGSFGYDDAWKVIRRAVEYLKREQK
PDGSWFGRWGVNYLYGTGAVVSALKAVGIDTREPYIQKALDWVEQHQNPDGGWGEDCRSY
EDPAYAGKGASTPSQTAWALMALIAGGRAESEAARRGVQYLVETQRPDGGWDEPYYTGTG
FPGDFYLGYTMYRHVFPTLALGRYKQAIERR
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| BDBM50143433 |
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| n/a |
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| Name | BDBM50143433 |
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| Synonyms: | Acetic acid 4-acetoxy-3-[(2E,6E)-9-(3,3-dimethyl-oxiranyl)-3,7-dimethyl-nona-2,6-dienyl]-2-oxo-2H-chromen-7-yl ester | CHEMBL178379 |
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| Type | Small organic molecule |
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| Emp. Form. | C28H34O7 |
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| Mol. Mass. | 482.5654 |
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| SMILES | CC(=O)Oc1ccc2c(OC(C)=O)c(C\C=C(/C)CC\C=C(/C)CCC3OC3(C)C)c(=O)oc2c1 |
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| Structure | 
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