Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 7/20 | 0.39 |
| ▸ | HTR1B | P28222 | 7/20 | 0.39 |
| ▸ | HTR1A | P08908 | 7/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | CTPS1 | P17812 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.37 |
| ▸ | XIAP | P98170 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL1318385 | 0.86 | CDK8 (0.42) | CTPS1POLBMAPTTP53HTT | |
| SCHEMBL21864608 | 0.80 | PRKDC (0.46) | CTPS1ALDH1A1 | |
| SCHEMBL12115054 | 0.79 | CDK8 (0.40) | CTPS1POLBMAPTTP53HTT | |
| SCHEMBL21864583 | 0.79 | TBXAS1 (0.42) | MAPTKDM4EALDH1A1 | |
| SCHEMBL1320572 | 0.78 | CDK8 (0.45) | HTR1BCTPS1POLBMAPTTP53 | |
| SCHEMBL21831364 | 0.77 | CHEK2 (0.40) | — | |
| SCHEMBL12115074 | 0.77 | CDK8 (0.41) | CTPS1POLBMAPTTP53HTT | |
| SCHEMBL21864629 | 0.77 | HTR1D (0.41) | HTR1DHTR1BHTR1AXIAPSCN9A | |
| SCHEMBL12115120 | 0.75 | CDK8 (0.38) | POLBMAPTKDM4EALDH1A1 | |
| SCHEMBL1318684 | 0.74 | CDK8 (0.44) | HTR1BCTPS1POLBMAPTTP53 |
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 |