Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SSTR3 | P32745 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CD38 | P28907 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | PNMT | P11086 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9681343 | 0.84 | HDAC3 (0.44) | SHMT2ALDH1A1HDAC3NCOR1GAA | |
| SCHEMBL9683512 | 0.84 | TP53 (0.46) | SSTR3ALDH1A1GAAFFAR1TSHR | |
| SCHEMBL16489601 | 0.82 | ALDH1A1 (0.46) | SSTR3CYP2D6CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL12658350 | 0.81 | SHMT2 (0.48) | SHMT2ALDH1A1HDAC3NCOR1HDAC1 | |
| SCHEMBL10507600 | 0.80 | SSTR3 (0.51) | SSTR3ALDH1A1GAAFFAR1CD38 | |
| SCHEMBL9681871 | 0.78 | MAPT (0.43) | SHMT2ALDH1A1HDAC3NCOR1HDAC1 | |
| SCHEMBL11569274 | 0.78 | ALDH1A1 (0.49) | ALDH1A1GAACISD1 | |
| SCHEMBL9683160 | 0.76 | MAPT (0.54) | SSTR3CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL18768917 | 0.76 | CYP1A2 (0.59) | SSTR3CYP2D6CYP2C9CYP2C19CYP1A2 | |
| SCHEMBL9683331 | 0.75 | MAP2K4 (0.52) | GAAHDAC1 |
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-5128359-A | Benzimidazole and azabenzimidazole derivatives which are thromboxane receptor antagonists, their methods of preparation | LABORATOIRES UPSA (FR) | 1992-07-07 | — | — | US | disclosed |
| US-5124336-A | Cardiovascular disorders | LABORATOIRES UPSA (FR) | 1992-06-23 | — | — | US | disclosed |
| US-5021443-A | Noval benzimidazole and azabenzimiazole derivatives which are thromboxane receptor antagonists, their methods of preparation and pharmaceutical compositions in which they are present | LABORATOIRES UPSA (FR) | 1991-06-04 | — | — | US | disclosed |