Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLD1 | Q13393 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3258812 | 1.00 | PLD1 (0.58) | PLD1KDM4EALDH1A1MAPTHSD17B10 | |
| Hydrochloric Acid SCHEMBL20337933 | 0.98 | PLD1 (0.56) | PLD1KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL28434892 | 0.95 | PLD1 (0.53) | PLD1KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL29857922 | 0.86 | PLD1 (0.73) | PLD1KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL21353591 | 0.86 | — | — | |
| SCHEMBL15800694 | 0.86 | PLD1 (0.73) | PLD1KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL25561240 | 0.80 | ALDH1A1 (0.61) | PLD1ALDH1A1HSD17B10HPGDSMN1; SMN2 | |
| SCHEMBL27580597 | 0.80 | ALDH1A1 (0.82) | KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2 | |
| SCHEMBL4002258 | 0.80 | KDM4E (0.55) | PLD1KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL14562620 | 0.80 | ALDH1A1 (0.64) | KDM4EALDH1A1HSD17B10HPGDSMN1; SMN2 |
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-3307067-B1 | AMINOPYRAZINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES | MERCK SHARP & DOHME LLC (US) | 2022-11-02 | — | — | EP | claimed |
| WO-2024131265-A1 | COMPOUND FOR TREATING PI3Kγ-MEDIATED DISEASES AND USE THEREOF | 中国科学院合肥物质科学研究院 | 2024-06-27 | — | — | WO | disclosed |