Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 13/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 13/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 13/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 12/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.52 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | BRS3 | P32247 | 2/20 | 0.50 |
| ▸ | NOS2 | P35228 | 2/20 | 0.47 |
| ▸ | NOS3 | P29474 | 1/20 | 0.47 |
| ▸ | NOS1 | P29475 | 1/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 12/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 12/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 12/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8552373 | 0.91 | CYP2D6 (0.54) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL9026970 | 0.89 | CYP1A2 (0.54) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL8501286 | 0.89 | CYP2D6 (0.53) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL8503057 | 0.89 | CYP2C9 (0.53) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL10713337 | 0.88 | BRS3 (0.57) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL9027024 | 0.87 | CYP2D6 (0.49) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL9025242 | 0.85 | CYP2C9 (0.70) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL9026559 | 0.85 | CYP2C9 (0.59) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL8130650 | 0.83 | CYP2D6 (0.52) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL9025923 | 0.83 | BRS3 (0.48) | CYP2D6CYP2C9CYP2C19CYP1A2CYP3A4 |
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-0295603-B1 | Benzimidazol derivatives and therapeutic agent for ulcer comprising the same | EISAI CO LTD (JP) | 1996-09-18 | — | — | EP | disclosed |
| EP-0295603-A1 | Benzimidazol derivatives and therapeutic agent for ulcer comprising the same | Eisai Co., Ltd. (JP) | 1988-12-21 | — | — | EP | disclosed |