Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.43 |
| ▸ | TRAP1 | Q12931 | 5/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | HSP90B1 | P14625 | 3/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9683520 | 0.90 | TRPM5 (0.43) | AKR1B1MEN1KMT2AADRA2BALDH1A1 | |
| SCHEMBL9681422 | 0.86 | HDAC1 (0.40) | AKR1B1TRAP1HSP90B1MAPTKDM1A | |
| SCHEMBL9682901 | 0.78 | MAPT (0.43) | AKR1B1MEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL9682449 | 0.77 | TRAP1 (0.44) | AKR1B1TRAP1HSP90AA1HSP90AB1HSP90B1 | |
| SCHEMBL7746178 | 0.76 | AKR1B1 (0.66) | AKR1B1KMT2ALMNAMAPTAKR1A1 | |
| SCHEMBL9681992 | 0.75 | HDAC8 (0.42) | MEN1KMT2AMAPTL3MBTL1 | |
| SCHEMBL25828139 | 0.74 | PTGER4 (0.56) | LMNAMAPTHTTALDH1A1CYP1A2 | |
| SCHEMBL23630649 | 0.72 | MAPT (0.44) | MEN1KMT2ALMNAMAPTL3MBTL1 | |
| SCHEMBL11569274 | 0.72 | ALDH1A1 (0.49) | MEN1KMT2AMAPTALDH1A1HPGD | |
| SCHEMBL6744214 | 0.72 | ALDH1A1 (0.42) | ALDH1A1HPGD |
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-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 |