Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 7/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 1/20 | 0.40 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.40 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29796135 | 0.80 | ALDH1A1 (0.48) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL23213140 | 0.80 | ALDH1A1 (0.48) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL4606178 | 0.78 | ALDH1A1 (0.57) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL4717161 | 0.76 | HSP90AA1 (0.46) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL1019778 | 0.74 | F2 (0.45) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL20501018 | 0.74 | ALDH1A1 (0.44) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL13426427 | 0.73 | PDE4B (0.47) | ALDH1A1PKMMAPTRAB9ANR3C2 | |
| SCHEMBL31226734 | 0.73 | ALDH1A1 (0.45) | ALDH1A1PKMMAPTMEN1KMT2A | |
| SCHEMBL21296822 | 0.72 | ALDH1A1 (0.44) | ALDH1A1PKMMAPTRAB9ANR3C2 | |
| SCHEMBL29938392 | 0.72 | ALDH1A1 (0.44) | ALDH1A1PKMMAPTRAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-5681833-A | ADMINSTERING FOR TREATMENT OF PEPTIC ULCER | MERCK, SHARP & DOHME LTD. (GB) | 1997-10-28 | — | — | US | disclosed |
| WO-1993019052-A1 | 3-UREIDO SUBSTITUTED BENZODIAZEPIN-2-ONES HAVING CHOLECYSTOKININ AND/OR GASTRIN ANTAGONISTIC ACTIVITY AND THEIR USE IN THERAPY | MERCK SHARP & DOHME LIMITED (GB) | 1993-09-30 | — | — | WO | disclosed |