Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.48 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.45 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 8/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18603128 | 0.88 | EPHX1 (0.55) | EPHX1HRH4HRH3CHRNB2CHRNB4 | |
| SCHEMBL9050615 | 0.84 | HRH4 (0.49) | HRH4HRH3CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL20073977 | 0.81 | MEN1 (0.56) | EPHX1HRH4HRH3KCNA5CA1 | |
| SCHEMBL14587931 | 0.81 | EPHX1 (0.43) | EPHX1HRH4HRH3CHRNB2CHRNB4 | |
| SCHEMBL5949707 | 0.80 | EPHX1 (0.48) | EPHX1KCNA5GAA | |
| SCHEMBL6120869 | 0.80 | EPHX1 (0.41) | EPHX1HRH4HRH3CHRNB2CHRNB4 | |
| SCHEMBL6722031 | 0.78 | CYP2D6 (0.44) | HRH4HRH3CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL12654925 | 0.78 | HRH4 (0.42) | EPHX1HRH4HRH3USP2TSHR | |
| SCHEMBL8435124 | 0.78 | KDM4E (0.46) | HRH4HRH3CHRNB2CHRNB4CHRNA4 | |
| SCHEMBL6722028 | 0.78 | HRH4 (0.40) | EPHX1HRH4HRH3CHRNB2CHRNB4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3696181-A1 | PURINONES AS UBIQUITIN-SPECIFIC PROTEASE 1 INHIBITORS | Forma Therapeutics, Inc. (US) | 2020-08-19 | — | — | EP | disclosed |
| WO-2019003148-A1 | MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-01-03 | — | — | WO | disclosed |