Reaction Details |
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Target | Calmodulin-domain protein kinase 1 |
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Ligand | BDBM50345720 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_750529 (CHEMBL1786290) |
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IC50 | 54±n/a nM |
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Citation | Murphy, RC; Ojo, KK; Larson, ET; Castellanos-Gonzalez, A; Perera, BG; Keyloun, KR; Kim, JE; Bhandari, JG; Muller, NR; Verlinde, CL; White, AC; Merritt, EA; Van Voorhis, WC; Maly, DJ Discovery of Potent and Selective Inhibitors of Calcium-Dependent Protein Kinase 1 (CDPK1) from C. parvum and T. gondii. ACS Med Chem Lett1:331-335 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Calmodulin-domain protein kinase 1 |
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Name: | Calmodulin-domain protein kinase 1 |
Synonyms: | Calmodulin-domain protein kinase 1 | Calmodulin-domain protein kinase 1 (CDPK1) | Calmodulin-domain protein kinase, putative |
Type: | Enzyme Catalytic Domain |
Mol. Mass.: | 57248.42 |
Organism: | Toxoplasma gondii |
Description: | n/a |
Residue: | 507 |
Sequence: | MGQQESTLGGAAGEPRSRGHAAGTSGGPGDHLHATPGMFVQHSTAIFSDRYKGQRVLGKG
SFGEVILCKDKITGQECAVKVISKRQVKQKTDKESLLREVQLLKQLDHPNIMKLYEFFED
KGYFYLVGEVYTGGELFDEIISRKRFSEVDAARIIRQVLSGITYMHKNKIVHRDLKPENL
LLESKSKDANIRIIDFGLSTHFEASKKMKDKIGTAYYIAPEVLHGTYDEKCDVWSTGVIL
YILLSGCPPFNGANEYDILKKVEKGKYTFELPQWKKVSESAKDLIRKMLTYVPSMRISAR
DALDHEWIQTYTKEQISVDVPSLDNAILNIRQFQGTQKLAQAALLYMGSKLTSQDETKEL
TAIFHKMDKNGDGQLDRAELIEGYKELMRMKGQDASMLDASAVEHEVDQVLDAVDFDKNG
YIEYSEFVTVAMDRKTLLSRERLERAFRMFDSDNSGKISSTELATIFGVSDVDSETWKSV
LSEVDKNNDGEVDFDEFQQMLLKLCGN
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BDBM50345720 |
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n/a |
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Name | BDBM50345720 |
Synonyms: | 1-(1-(methylsulfonyl)piperidin-4-yl)-3-(naphthalen-1-ylmethyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine | CHEMBL1784972 | US10544104, Compound 5p | US11247972, Compound 5p | US9765037, Compound 5p |
Type | Small organic molecule |
Emp. Form. | C22H24N6O2S |
Mol. Mass. | 436.53 |
SMILES | CS(=O)(=O)N1CCC(CC1)n1nc(Cc2cccc3ccccc23)c2c(N)ncnc12 |
Structure |
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