Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLH | Q9Y253 | 7/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.62 |
| ▸ | GAA | P10253 | 6/20 | 0.62 |
| ▸ | POLB | P06746 | 5/20 | 0.62 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | MAPT | P10636 | 4/20 | 0.62 |
| ▸ | RECQL | P46063 | 3/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.62 |
| ▸ | MMP1 | P03956 | 2/20 | 0.62 |
| ▸ | APEX1 | P27695 | 2/20 | 0.62 |
| ▸ | BLM | P54132 | 2/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.57 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.56 |
| ▸ | USP2 | O75604 | 2/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL23440439 | 0.90 | POLH (0.70) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440447 | 0.89 | POLH (0.69) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440441 | 0.87 | POLH (0.71) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440455 | 0.85 | POLH (0.69) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440454 | 0.84 | POLH (0.67) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440436 | 0.84 | POLH (0.70) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440423 | 0.83 | POLH (0.72) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440453 | 0.83 | POLH (0.75) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL23440417 | 0.81 | EPHX2 (0.70) | POLHKDM4EGAAPOLBMEN1 | |
| SCHEMBL10728956 | 0.81 | POLH (1.00) | POLHKDM4EGAAPOLBMEN1 |
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-2021104416-A1 | COMPOUNDS AND METHODS FOR TREATING INFLAMMATORY BOWEL DISEASE | MEDICAL AND PHARMACEUTICAL INDUSTRY TECHNOLOGY AND DEVELOPMENT CENTER (CN) | 2021-06-03 | — | — | WO | disclosed |