Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
| ▸ | PTGFR | P43088 | 1/20 | 0.34 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.34 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 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 | |
|---|---|---|---|---|
| SCHEMBL8791943 | 0.88 | HPGD (0.42) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL3924427 | 0.85 | GAA (0.38) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL9106592 | 0.85 | TAS1R3 (0.38) | HPGDTAS1R3TAS1R1MAPTALDH1A1 | |
| SCHEMBL8794253 | 0.83 | MAPT (0.37) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL3928912 | 0.82 | GAA (0.42) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL9846648 | 0.82 | HPGD (0.35) | HPGDTAS1R3TAS1R1MAPTALDH1A1 | |
| SCHEMBL11735625 | 0.79 | PPARA (0.43) | HPGDTAS1R3TAS1R1MAPTFBP1 | |
| SCHEMBL4323776 | 0.78 | HPGD (0.44) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL4323474 | 0.78 | HPGD (0.44) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL4328403 | 0.78 | HPGD (0.44) | HPGDMAPTALDH1A1SMN1; SMN2NPC1 |
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-5091409-A | Useful in treatment of ocular hypertension and glaucoma | MERCK & CO., INC. (US) | 1992-02-25 | — | — | US | disclosed |
| EP-0457586-A1 | 4-alkylamino-6-(C3-5-hydrocarbyl)thieno [2,3-B] thiopyran-2-sulfonamide-7,7-dioxides | MERCK & CO. INC. (US) | 1991-11-21 | — | — | EP | disclosed |