Reaction Details |
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Target | Falcipain-2 |
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Ligand | BDBM12037 |
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Substrate/Competitor | BDBM12033 |
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Meas. Tech. | Falcipain Enzyme Inhibition Assay |
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pH | 5.5±n/a |
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Temperature | 295.15±n/a K |
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IC50 | 1800±n/a nM |
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Citation | Dominguez, JN; Leon, C; Rodrigues, J; Gamboa de Dominguez, N; Gut, J; Rosenthal, PJ Synthesis and evaluation of new antimalarial phenylurenyl chalcone derivatives. J Med Chem48:3654-8 (2005) [PubMed] Article |
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More Info.: | Get all data from this article, Inhibition_Run data, Solution Info, Assay Method |
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Falcipain-2 |
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Name: | Falcipain-2 |
Synonyms: | n/a |
Type: | Enzyme |
Mol. Mass.: | 55912.57 |
Organism: | Plasmodium falciparum |
Description: | n/a |
Residue: | 484 |
Sequence: | MDYNMDYAPHEVISQQGERFVDKYVDRKILKNKKSLLVIISLSVLSVVGFVLFYFTPNSR
KSDLFKNSSVENNNDDYIINSLLKSPNGKKFIVSKIDEALSFYDSKKNDINKYNEGNNNN
NADFKGLSLFKENTPSNNFIHNKDYFINFFDNKFLMNNAEHINQFYMFIKTNNKQYNSPN
EMKERFQVFLQNAHKVNMHNNNKNSLYKKELNRFADLTYHEFKNKYLSLRSSKPLKNSKY
LLDQMNYEEVIKKYRGEENFDHAAYDWRLHSGVTPVKDQKNCGSCWAFSSIGSVESQYAI
RKNKLITLSEQELVDCSFKNYGCNGGLINNAFEDMIELGGICPDGDYPYVSDAPNLCNID
RCTEKYGIKNYLSVPDNKLKEALRFLGPISISVAVSDDFAFYKEGIFDGECGDELNHAVM
LVGFGMKEIVNPLTKKGEKHYYYIIKNSWGQQWGERGFINIETDESGLMRKCGLGTDAFI
PLIE
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BDBM12037 |
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BDBM12033 |
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Name | BDBM12037 |
Synonyms: | 3-(4-chlorophenyl)-1-{4-[(2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]phenyl}urea | Phenylurenyl Chalcone deriv. 27 |
Type | Small organic molecule |
Emp. Form. | C25H23ClN2O5 |
Mol. Mass. | 466.914 |
SMILES | COc1cc(\C=C\C(=O)c2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc(OC)c1OC |
Structure |
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