Reaction Details |
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Target | Sonic hedgehog protein |
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Ligand | BDBM50401325 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_883326 (CHEMBL2213635) |
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IC50 | 4.9±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 |
Synonyms: | Hhg1 | SHH_MOUSE | Shh |
Type: | Protein |
Mol. Mass.: | 47784.50 |
Organism: | Mus musculus (Mouse) |
Description: | Q62226 |
Residue: | 437 |
Sequence: | MLLLLARCFLVILASSLLVCPGLACGPGRGFGKRRHPKKLTPLAYKQFIPNVAEKTLGAS
GRYEGKITRNSERFKELTPNYNPDIIFKDEENTGADRLMTQRCKDKLNALAISVMNQWPG
VKLRVTEGWDEDGHHSEESLHYEGRAVDITTSDRDRSKYGMLARLAVEAGFDWVYYESKA
HIHCSVKAENSVAAKSGGCFPGSATVHLEQGGTKLVKDLRPGDRVLAADDQGRLLYSDFL
TFLDRDEGAKKVFYVIETLEPRERLLLTAAHLLFVAPHNDSGPTPGPSALFASRVRPGQR
VYVVAERGGDRRLLPAAVHSVTLREEEAGAYAPLTAHGTILINRVLASCYAVIEEHSWAH
RAFAPFRLAHALLAALAPARTDGGGGGSIPAAQSATEARGAEPTAGIHWYSQLLYHIGTW
LLDSETMHPLGMAVKSS
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BDBM50401325 |
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n/a |
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Name | BDBM50401325 |
Synonyms: | CHEMBL2205228 |
Type | Small organic molecule |
Emp. Form. | C28H33FN4O6 |
Mol. Mass. | 540.5832 |
SMILES | CCc1cc2n(C)c(C(=O)NC3CCN(CC3)C(=O)CO)c(OCCF)c2c(=O)n1CC(=O)c1ccccc1 |
Structure |
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