Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 5/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 5/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 5/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10698484 | 0.91 | PTGS2 (0.47) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10701037 | 0.84 | CYP2E1 (0.48) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10700992 | 0.80 | PTGS2 (0.42) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10699185 | 0.80 | PTGS2 (0.48) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10699983 | 0.79 | OPRL1 (0.45) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10700412 | 0.78 | PLG (0.34) | NPC1RAB9AHPGDALDH1A1MAPT | |
| SCHEMBL10699937 | 0.77 | SMN1; SMN2 (0.46) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10699503 | 0.77 | PTGS2 (0.49) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10701747 | 0.74 | BRS3 (0.45) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10700028 | 0.73 | PTGS2 (0.43) | PTGS2CYP2E1CYP2C8CYP2D6CYP2C9 |
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-0251536-A1 | Benzimidazoles, their production, formulation and use as gastric acid secretion inhibitors | FISONS plc (GB) | 1988-01-07 | — | — | EP | claimed |
| EP-0251536-A1 | Benzimidazoles, their production, formulation and use as gastric acid secretion inhibitors | FISONS plc (GB) | 1988-01-07 | — | — | EP | disclosed |