| Reaction Details |
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 | Report a problem with these data |
| Target | Sonic hedgehog protein |
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| Ligand | BDBM50401331 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_883326 (CHEMBL2213635) |
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| IC50 | 96±n/a nM |
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| Citation |  Ohashi, T; Oguro, Y; Tanaka, T; Shiokawa, Z; Tanaka, Y; Shibata, S; Sato, Y; Yamakawa, H; Hattori, H; Yamamoto, Y; Kondo, S; Miyamoto, M; Nishihara, M; Ishimura, Y; Tojo, H; Baba, A; Sasaki, S Discovery of the investigational drug TAK-441, a pyrrolo[3,2-c]pyridine derivative, as a highly potent and orally active hedgehog signaling inhibitor: modification of the core skeleton for improved solubility. Bioorg Med Chem20:5507-17 (2012) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Sonic hedgehog protein |
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| Name: | Sonic hedgehog protein |
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| Synonyms: | Hhg1 | SHH_MOUSE | Shh |
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| Type: | Protein |
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| Mol. Mass.: | 47784.50 |
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| Organism: | Mus musculus (Mouse) |
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| Description: | Q62226 |
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| Residue: | 437 |
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| Sequence: | MLLLLARCFLVILASSLLVCPGLACGPGRGFGKRRHPKKLTPLAYKQFIPNVAEKTLGAS
GRYEGKITRNSERFKELTPNYNPDIIFKDEENTGADRLMTQRCKDKLNALAISVMNQWPG
VKLRVTEGWDEDGHHSEESLHYEGRAVDITTSDRDRSKYGMLARLAVEAGFDWVYYESKA
HIHCSVKAENSVAAKSGGCFPGSATVHLEQGGTKLVKDLRPGDRVLAADDQGRLLYSDFL
TFLDRDEGAKKVFYVIETLEPRERLLLTAAHLLFVAPHNDSGPTPGPSALFASRVRPGQR
VYVVAERGGDRRLLPAAVHSVTLREEEAGAYAPLTAHGTILINRVLASCYAVIEEHSWAH
RAFAPFRLAHALLAALAPARTDGGGGGSIPAAQSATEARGAEPTAGIHWYSQLLYHIGTW
LLDSETMHPLGMAVKSS
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| BDBM50401331 |
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| n/a |
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| Name | BDBM50401331 |
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| Synonyms: | CHEMBL2205231 |
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| Type | Small organic molecule |
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| Emp. Form. | C29H34N4O6 |
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| Mol. Mass. | 534.6035 |
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| SMILES | COc1c(C(=O)NC2CCN(CC2)C(=O)CO)n(C)c2c3CCCCc3n(CC(=O)c3ccccc3)c(=O)c12 |
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| Structure | 
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