Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 2/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7350285 | 0.99 | SIGMAR1 (0.41) | SIGMAR1HTR1ADRD4PARP1HDAC1 | |
| Hydrochloric Acid SCHEMBL7359064 | 0.91 | SIGMAR1 (0.43) | SIGMAR1HTR1ADRD4PARP1KDM4E | |
| SCHEMBL7354508 | 0.90 | SIGMAR1 (0.42) | SIGMAR1HTR1ADRD4PARP1 | |
| SCHEMBL7354368 | 0.87 | HTR1A (0.40) | SIGMAR1HTR1ADRD4PARP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7357103 | 0.83 | HTR1A (0.47) | SIGMAR1HTR1ADRD4PARP1KDM4E | |
| SCHEMBL7359345 | 0.83 | HTR1A (0.47) | SIGMAR1HTR1ADRD4PARP1 | |
| SCHEMBL7353890 | 0.82 | SIGMAR1 (0.44) | SIGMAR1HTR1ADRD4PARP1ALDH1A1 | |
| SCHEMBL7386018 | 0.81 | SIGMAR1 (0.42) | SIGMAR1HTR1ADRD4PARP1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7359451 | 0.81 | SIGMAR1 (0.44) | SIGMAR1HTR1ADRD4PARP1ALDH1A1 | |
| SCHEMBL7361803 | 0.81 | HDAC1 (0.46) | HDAC1HDAC6ALDH1A1KDM4EGAA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995003298-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS DOPAMINE RECEPTOR ANTAGONIST, 5-HT RECEPTOR AGONIST OR α1 RECEPTOR ANTAGONIST | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-02-02 | — | — | WO | disclosed |