Reaction Details | |||
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Target | Carbonic anhydrase 12 | ||
Ligand | BDBM50241354 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1523544 (CHEMBL3631192) | ||
Temperature | 298.15±n/a K | ||
Ki | 52±n/a nM | ||
Comments | extracted | ||
Citation | Karioti, A; Ceruso, M; Carta, F; Bilia, AR; Supuran, CT New natural product carbonic anhydrase inhibitors incorporating phenol moieties. Bioorg Med Chem23:7219-25 (2015) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Carbonic anhydrase 12 | |||
Name: | Carbonic anhydrase 12 | ||
Synonyms: | CA-XII | CA12 | CAH12_HUMAN | Carbonate dehydratase XII | Carbonic anhydrase | Carbonic anhydrase 12 (CA XII) | Carbonic anhydrase XII | Carbonic anhydrase XII (CA XII) | Carbonic anhydrase XII (CAXII) | Tumor antigen HOM-RCC-3.1.3 | ||
Type: | Enzyme | ||
Mol. Mass.: | 39456.00 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Catalytic domain of human cloned isozyme was used in the assay | ||
Residue: | 354 | ||
Sequence: |
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BDBM50241354 | |||
n/a | |||
Name | BDBM50241354 | ||
Synonyms: | 2-(3,4-Dihydroxy-phenyl)-5,7-dihydroxy-3-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-chromen-4-one | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one | 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yloxy)-4H-chromen-4-one | 3,3',4',5,7-pentahydroxyflavone-3-beta-O-glucoside | 3-glucoside isoquercitrin | CHEMBL250450 | Hyperin | Hyperoside | NSC-407304 | Quercetin 3-O-beta-D-glucoside | Quercetin-3-O-beta-D-galactopyranoside | Quercetin-3-glucoside | cid_5280804 | cid_5378597 | hirsutrin | hydroside | isoquercetin | isoquercetrin | quercetin -3-O-beta-D-galactopyranoside | quercetin 3-O-beta-D-galactopyranoside | quercetin 3-O-beta-D-glucopyranoside | quercetin 3-O-galactoside | quercetin 3-O-glucopyranoside | quercetin 3-O-glucoside | quercetin-3-galactoside | ||
Type | Small organic molecule | ||
Emp. Form. | C21H20O12 | ||
Mol. Mass. | 464.3763 | ||
SMILES | OC[C@H]1O[C@@H](Oc2c(O)c3c(cc(O)cc3=O)oc2-c2ccc(O)c(O)c2)[C@H](O)[C@@H](O)[C@@H]1O |r| | ||
Structure |