Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.65 |
| ▸ | SRC | P12931 | 5/20 | 0.65 |
| ▸ | POLH | Q9Y253 | 8/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.64 |
| ▸ | POLB | P06746 | 4/20 | 0.64 |
| ▸ | RECQL | P46063 | 4/20 | 0.64 |
| ▸ | MEN1 | O00255 | 4/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.64 |
| ▸ | APEX1 | P27695 | 3/20 | 0.64 |
| ▸ | GAA | P10253 | 3/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.64 |
| ▸ | MMP1 | P03956 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | BLM | P54132 | 2/20 | 0.64 |
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | USP2 | O75604 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL23442025 | 0.90 | EPHX2 (0.63) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL4170634 | 0.86 | POLH (0.74) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL4165291 | 0.84 | POLH (0.71) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL23440446 | 0.84 | POLH (0.68) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL23441996 | 0.84 | EPHX2 (0.82) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL23442029 | 0.82 | SRC (0.59) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL29376458 | 0.82 | EPHX2 (0.64) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL31236662 | 0.82 | POLH (0.76) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL4175201 | 0.82 | POLH (0.76) | EPHX2SRCPOLHKDM4EPOLB | |
| SCHEMBL7940707 | 0.82 | EPHX2 (0.72) | EPHX2SRCPOLHKDM4EPOLB |
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 |