Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.71 |
| ▸ | DRD4 | P21917 | 3/20 | 0.71 |
| ▸ | DRD3 | P35462 | 3/20 | 0.71 |
| ▸ | CBFB | Q13951 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 3/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7619109 | 0.86 | DRD2 (0.67) | DRD2DRD4DRD3CBFBDHODH | |
| SCHEMBL8126835 | 0.83 | DRD4 (1.00) | DRD2DRD4DRD3 | |
| SCHEMBL13165012 | 0.80 | DRD2 (0.60) | DRD2DRD4DRD3CBFBPARP1 | |
| SCHEMBL6510308 | 0.78 | DRD2 (0.49) | DRD2DRD4DRD3CBFBPARP1 | |
| SCHEMBL9529218 | 0.78 | DRD2 (0.45) | DRD2DRD4DRD3IDO1CYP11B1 | |
| SCHEMBL9528482 | 0.78 | MEN1 (0.59) | DRD2DRD4DRD3CBFBDHODH | |
| SCHEMBL7612954 | 0.74 | DRD2 (0.53) | DRD2DRD4DRD3CBFBDHODH | |
| SCHEMBL9528411 | 0.74 | DRD2 (0.53) | DRD2DRD4DRD3CBFBDHODH | |
| SCHEMBL6510296 | 0.74 | DRD2 (0.45) | DRD2DRD4DRD3CBFBPARP1 | |
| SCHEMBL4611125 | 0.74 | ALDH1A1 (0.55) | DRD2DRD4DRD3CBFBDHODH |
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 |
|---|---|---|---|---|---|---|---|
| EP-0266326-B1 | NOVEL DERIVATIVES OF BENZIMIDAZOLES ACTIVE AS ANTI-ULCER AGENTS | Aktiebolaget Hässle (SE) | 1993-03-10 | — | — | EP | disclosed |
| US-5106862-A | DERIVATIVES OF BENZIMIDAZOLES ACTIVE AS ANTI-ULCER AGENTS | AKTIEBOLAGET HASSLE (SE) | 1992-04-21 | — | — | US | disclosed |
| EP-0266326-A1 | Novel derivatives of benzimidazoles active as anti-ulcer agents | Aktiebolaget Hässle (SE) | 1988-05-04 | — | — | EP | disclosed |