Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.34 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5236494 | 0.91 | GAA (0.35) | GAAUSP2OPRM1CACNA2D1ALDH1A1 | |
| SCHEMBL5237036 | 0.89 | CACNA2D1 (0.42) | OPRM1CACNA2D1KDM4EALDH1A1POLB | |
| SCHEMBL5231976 | 0.88 | ATM (0.37) | GAAKMT2AMEN1CYP3A4CYP2C19 | |
| SCHEMBL5231969 | 0.88 | ATM (0.37) | GAAKMT2AMEN1CYP3A4CYP2C19 | |
| SCHEMBL5233869 | 0.88 | OPRM1 (0.36) | GAAKMT2AUSP2BRD4OPRM1 | |
| SCHEMBL5237215 | 0.88 | CACNA2D1 (0.36) | KMT2AMEN1NPC1RAB9AOPRM1 | |
| SCHEMBL5238148 | 0.86 | POLB (0.40) | OPRM1CACNA2D1KDM4EALDH1A1POLB | |
| SCHEMBL5237690 | 0.85 | CACNA2D1 (0.41) | KMT2AMEN1NPC1RAB9AOPRM1 | |
| SCHEMBL5235781 | 0.85 | ALDH1A1 (0.34) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL5233912 | 0.84 | KDM4E (0.42) | GAAKMT2ANPC1RAB9AMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1730116-B1 | 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORP (US) | 2007-09-05 | — | — | EP | claimed |