Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 14/20 | 0.53 |
| ▸ | DRD4 | P21917 | 2/20 | 0.52 |
| ▸ | DRD3 | P35462 | 2/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.48 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.48 |
| ▸ | HTR1A | P08908 | 5/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.47 |
| ▸ | HTR1D | P28221 | 3/20 | 0.47 |
| ▸ | HTR1B | P28222 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | MLNR | O43193 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
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 SCHEMBL11198122 | 0.82 | DRD2 (0.55) | DRD2DRD4DRD3SCN1ASCN5A | |
| Hydrochloric Acid SCHEMBL11203073 | 0.79 | DRD2 (0.78) | DRD2DRD4DRD3SCN1ASCN5A | |
| SCHEMBL11194827 | 0.77 | DRD2 (0.49) | DRD2DRD4DRD3SCN1ASCN5A | |
| SCHEMBL11199800 | 0.77 | DRD2 (0.60) | DRD2DRD4DRD3SCN1ASCN5A | |
| SCHEMBL11197104 | 0.76 | DRD2 (0.52) | DRD2DRD4DRD3SCN1ASCN5A | |
| Bromide SCHEMBL11196359 | 0.76 | DRD2 (0.48) | DRD2DRD4DRD3SCN1ASCN5A | |
| Hydrochloric Acid SCHEMBL11204105 | 0.75 | DRD2 (0.61) | DRD2DRD4DRD3SCN1ASCN5A | |
| Hydrochloric Acid SCHEMBL11196563 | 0.75 | DRD2 (0.47) | DRD2DRD4DRD3SCN1ASCN5A | |
| SCHEMBL11201027 | 0.75 | ALDH1A1 (0.52) | DRD2DRD4DRD3SCN1ASCN5A | |
| SCHEMBL11194927 | 0.75 | DRD2 (0.60) | DRD2DRD4DRD3SCN1ASCN5A |
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 |
|---|---|---|---|---|---|---|---|
| US-5691341-A | ANTILEUKEMIA AGENT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1997-11-25 | — | — | US | disclosed |
| EP-0623598-A1 | APOPTOSIS REGULATOR | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-11-09 | — | — | EP | disclosed |
| US-4415572-A | CARDIOTONIC AND INOTROPIC AGENTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1983-11-15 | — | — | US | disclosed |