Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 6/20 | 0.36 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | OGA | O60502 | 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 | |
|---|---|---|---|---|
| SCHEMBL22280319 | 0.86 | TGFBR1 (0.49) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL851358 | 0.74 | ALDH1A1 (0.69) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL29540343 | 0.74 | ALDH1A1 (0.69) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL22955472 | 0.74 | TGFBR1 (0.49) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| Hydrochloric Acid SCHEMBL29488564 | 0.73 | ALDH1A1 (0.67) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL22672598 | 0.72 | ALDH1A1 (0.56) | HPGDALDH1A1ALOX15HSD17B10NPC1 | |
| SCHEMBL31603641 | 0.71 | TGFBR1 (0.43) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL30310860 | 0.68 | KMT2A (0.55) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL18911366 | 0.67 | ADORA3 (0.48) | TGFBR1HPGDALDH1A1ALOX15HSD17B10 | |
| SCHEMBL23772187 | 0.66 | TDP1 (0.59) | HPGDALDH1A1KDM4ENPC1MAPT |
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-1196397-A1 | METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS AND THEIR USE FOR TREATING CENTRAL NERVOUS SYSTEM DISEASES | NPS PHARMACEUTICALS, INC. (US) | 2002-04-17 | — | — | EP | disclosed |
| WO-2000073283-A1 | METABOTROPIC GLUTAMATE RECEPTOR ANTAGONISTS AND THEIR USE FOR TREATING CENTRAL NERVOUS SYSTEM DISEASES | NPS PHARMACEUTICALS, INC. (US) | 2000-12-07 | — | — | WO | disclosed |