Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.57 |
| ▸ | AMY1A | P0DUB6 | 8/20 | 0.52 |
| ▸ | RUNX1 | Q01196 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | PDE5A | O76074 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7272145 | 0.86 | PDE2A (0.56) | PDE2AAMY1ARUNX1NPC1TP53 | |
| SCHEMBL7280215 | 0.84 | PDE2A (0.54) | PDE2AAMY1ARUNX1NPC1TP53 | |
| SCHEMBL10734755 | 0.83 | PDE2A (0.57) | PDE2AAMY1ARUNX1NPC1TP53 | |
| SCHEMBL7270959 | 0.81 | PDE2A (0.58) | PDE2AAMY1ANPC1KDM4ERAB9A | |
| Hydrochloric Acid SCHEMBL7272531 | 0.80 | PDE2A (0.57) | PDE2AAMY1ANPC1KDM4ERAB9A | |
| SCHEMBL12470674 | 0.79 | PDE2A (0.56) | PDE2AAMY1ANPC1TP53KDM4E | |
| SCHEMBL3337825 | 0.79 | PDE2A (0.66) | PDE2AAMY1ARUNX1NPC1TP53 | |
| SCHEMBL10690574 | 0.77 | PDE2A (0.51) | PDE2AAMY1ARUNX1KDM4EALDH1A1 | |
| SCHEMBL10188886 | 0.76 | AMY1A (0.55) | AMY1ARUNX1NPC1TP53KDM4E | |
| SCHEMBL10609972 | 0.76 | PDE2A (0.45) | PDE2AAMY1ARUNX1TP53KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4904785-A | INOTROPIC AGENTS FOR CARDIOVASCULAR DISORDERS | ELI LILLY AND COMPANY (US) | 1990-02-27 | — | — | US | disclosed |
| US-4758574-A | 2-phenylimidazio (4,5-c) pyridines | ELI LILLY AND COMPANY (US) | 1988-07-19 | — | — | US | disclosed |
| EP-0093593-A2 | Pyridine compounds | ELI LILLY AND COMPANY (US) | 1983-11-09 | — | — | EP | disclosed |