Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.69 |
| ▸ | HPGD | P15428 | 5/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.69 |
| ▸ | GAA | P10253 | 1/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | RHEB | Q15382 | 1/20 | 0.52 |
| ▸ | PKN1 | Q16512 | 3/20 | 0.52 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16498994 | 0.80 | ALDH1A1 (0.73) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL9679534 | 0.74 | NPC1 (0.67) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL9678498 | 0.73 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL9378150 | 0.73 | ALDH1A1 (0.62) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL16480441 | 0.73 | LMNA (0.58) | GAALMNARHEBNPC1RAB9A | |
| SCHEMBL24867413 | 0.73 | KDM4E (0.50) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL20982455 | 0.72 | ALDH1A1 (0.67) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL24075259 | 0.72 | GUSB (0.76) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL27202461 | 0.72 | ALDH1A1 (0.69) | ALDH1A1HPGDKDM4EGAAHSD17B10 | |
| SCHEMBL10578757 | 0.72 | KDM4E (0.50) | ALDH1A1HPGDKDM4EGAAHSD17B10 |
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-0207483-B1 | BENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION, MEDICAMENTS CONTAINING THEM AND INTERMEDIATES | Roche Diagnostics GmbH (DE) | 1992-03-18 | — | — | EP | disclosed |
| US-4831032-A | CARDIOVASCULAR DISORDERS, HYPOTENSIVE, ISOTROPIC AGENTS | BOEHRINGER MANNHEIM GMBH (DE) | 1989-05-16 | — | — | US | disclosed |
| EP-0207483-A2 | Benzimidazoles, process for their preparation, medicaments containing them and intermediates | Roche Diagnostics GmbH (DE) | 1987-01-07 | — | — | EP | disclosed |