| Reaction Details |
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 | Report a problem with these data |
| Target | Dihydrofolate reductase |
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| Ligand | BDBM226164 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Dihydrofolate Reductase (DHFR) Inhibition Assay |
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| pH | 7.4±n/a |
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| Temperature | 298.15±n/a K |
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| IC50 | 19000±1250 nM |
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| Comments | extracted |
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| Citation |  El-Gazzar, YI; Georgey, HH; El-Messery, SM; Ewida, HA; Hassan, GS; Raafat, MM; Ewida, MA; El-Subbagh, HI Synthesis, biological evaluation and molecular modeling study of new (1,2,4-triazole or 1,3,4-thiadiazole)-methylthio-derivatives of quinazolin-4(3H)-one as DHFR inhibitors Bioorg Chem72:282-292 (2017) |
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| More Info.: | Get all data from this article, Assay Method |
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| Dihydrofolate reductase |
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| Name: | Dihydrofolate reductase |
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| Synonyms: | DHFR | DYR_BOVIN | Dihydrofolate reductase | Dihydrofolate reductase (DHFR) |
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| Type: | Enzyme |
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| Mol. Mass.: | 21603.71 |
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| Organism: | Bos taurus (Cattle) |
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| Description: | P00376 |
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| Residue: | 187 |
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| Sequence: | MVRPLNCIVAVSQNMGIGKNGDLPWPPLRNEFQYFQRMTTVSSVEGKQNLVIMGRKTWFS
IPEKNRPLKDRINIVLSRELKEPPKGAHFLAKSLDDALELIEDPELTNKVDVVWIVGGSS
VYKEAMNKPGHVRLFVTRIMQEFESDAFFPEIDFEKYKLLPEYPGVPLDVQEEKGIKYKF
EVYEKNN
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|
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| BDBM226164 |
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| n/a |
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| Name | BDBM226164 |
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| Synonyms: | N'-[4-Chlorobenzylidene-2-(6-chloro)-3-(4-methoxy-phenyl)-4-oxo-3,4-dihydroquinazolin-2-yl-thio]acetohydrazide (16) |
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| Type | Small organic molecule |
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| Emp. Form. | C24H18Cl2N4O3S |
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| Mol. Mass. | 513.396 |
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| SMILES | COc1ccc(cc1)-n1c(SCC(=O)N\N=C\c2ccc(Cl)cc2)nc2ccc(Cl)cc2c1=O |
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| Structure | 
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