Calothrixin B
| Internal ID | 41d188c8-c241-47d9-99e7-78f0755b450e |
| Taxonomy | Organoheterocyclic compounds > Quinolines and derivatives > Benzoquinolines > Phenanthridines and derivatives |
| IUPAC Name | 10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C19H10N2O2/c22-18-12-9-20-13-7-3-1-5-10(13)15(12)19(23)17-16(18)11-6-2-4-8-14(11)21-17/h1-9,21H |
| InChI Key | CCPDIHKLISWESE-UHFFFAOYSA-N |
| Popularity | 35 references in papers |
| Molecular Formula | C19H10N2O2 |
| Molecular Weight | 298.30 g/mol |
| Exact Mass | 298.074227566 g/mol |
| Topological Polar Surface Area (TPSA) | 62.80 Ų |
| XlogP | 3.60 |
| 254114-34-6 |
| DTXSID80431277 |
| RefChem:123039 |
| DTXCID30382109 |
| 7H,12H,13H-quinolino(4,3-b)carbazole-7,13-dione |
| 10,20-diazapentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1(13),3(11),4,6,8,14,16,18,20-nonaene-2,12-dione |
| 7H-Indolo[3,2-j]phenanthridine-7,13(12H)-dione |
| CHEMBL362573 |
| SCHEMBL5222737 |
| SCHEMBL29375353 |
| There are more than 10 synonyms. If you wish to see them all click here. |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL1951 | P21397 | Monoamine oxidase A | 95.84% | 91.49% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 95.62% | 95.56% |
| CHEMBL1937 | Q92769 | Histone deacetylase 2 | 95.52% | 94.75% |
| CHEMBL4145 | Q9UKV0 | Histone deacetylase 9 | 92.63% | 85.49% |
| CHEMBL2708 | Q16584 | Mitogen-activated protein kinase kinase kinase 11 | 92.50% | 81.14% |
| CHEMBL3524 | P56524 | Histone deacetylase 4 | 92.20% | 92.97% |
| CHEMBL1806 | P11388 | DNA topoisomerase II alpha | 92.18% | 89.00% |
| CHEMBL3038477 | P67870 | Casein kinase II alpha/beta | 91.63% | 99.23% |
| CHEMBL255 | P29275 | Adenosine A2b receptor | 91.20% | 98.59% |
| CHEMBL2535 | P11166 | Glucose transporter | 91.07% | 98.75% |
| CHEMBL2581 | P07339 | Cathepsin D | 90.67% | 98.95% |
| CHEMBL2095172 | P14867 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 90.60% | 92.67% |
| CHEMBL1781 | P11387 | DNA topoisomerase I | 89.61% | 97.00% |
| CHEMBL2378 | P30307 | Dual specificity phosphatase Cdc25C | 89.09% | 96.67% |
| CHEMBL1829 | O15379 | Histone deacetylase 3 | 88.64% | 95.00% |
| CHEMBL3310 | Q96DB2 | Histone deacetylase 11 | 88.04% | 88.56% |
| CHEMBL4302 | P08183 | P-glycoprotein 1 | 87.01% | 92.98% |
| CHEMBL5619 | P27695 | DNA-(apurinic or apyrimidinic site) lyase | 85.86% | 91.11% |
| CHEMBL2635 | P51452 | Dual specificity protein phosphatase 3 | 85.69% | 94.00% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 85.45% | 90.08% |
| CHEMBL2716 | Q8WUI4 | Histone deacetylase 7 | 84.93% | 89.44% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 84.61% | 97.64% |
| CHEMBL1868 | P17948 | Vascular endothelial growth factor receptor 1 | 84.14% | 96.47% |
| CHEMBL2035 | P08912 | Muscarinic acetylcholine receptor M5 | 82.92% | 94.62% |
| CHEMBL2094121 | P14867 | GABA-A receptor; alpha-1/beta-3/gamma-2 | 82.02% | 95.50% |
| CHEMBL3192 | Q9BY41 | Histone deacetylase 8 | 82.02% | 93.99% |
| CHEMBL1075094 | Q16236 | Nuclear factor erythroid 2-related factor 2 | 80.56% | 96.00% |
| CHEMBL3401 | O75469 | Pregnane X receptor | 80.56% | 94.73% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| There are no matching plants. |
| PubChem | 9817721 |
| LOTUS | LTS0215262 |
| wikiData | Q77500319 |