Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | HPGD | P15428 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21864685 | 0.84 | CA9 (0.38) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864600 | 0.83 | KDM4E (0.40) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864738 | 0.83 | NR4A2 (0.38) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864736 | 0.81 | GSK3B (0.40) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864641 | 0.79 | PDE4D (0.35) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864645 | 0.79 | PDE4D (0.35) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864601 | 0.78 | CA12 (0.40) | CA12CA9KDM4EALDH1A1HPGD | |
| SCHEMBL21864570 | 0.77 | CHEK2 (0.47) | CA12CA9KDM4EMAOBALDH1A1 | |
| SCHEMBL21864581 | 0.76 | ABL1 (0.45) | CA9KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL21864604 | 0.76 | ALDH1A1 (0.38) | CA12CA9KDM4EALDH1A1HPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020071550-A1 | CDK8 INHIBITOR AND USE OF SAME | 京都薬品工業株式会社 | 2020-04-09 | — | — | WO | disclosed |