Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 7/20 | 0.51 |
| ▸ | DRD3 | P35462 | 7/20 | 0.51 |
| ▸ | DRD2 | P14416 | 6/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 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 SCHEMBL11220155 | 0.99 | DRD4 (0.50) | DRD4DRD3DRD2MAPK14CYP2D6 | |
| SCHEMBL11223325 | 0.89 | SLC6A3 (0.42) | DRD4DRD3DRD2MAPK14L3MBTL1 | |
| SCHEMBL11224937 | 0.85 | DRD3 (0.43) | DRD4DRD3DRD2MAPK14L3MBTL1 | |
| Hydrochloric Acid SCHEMBL10669369 | 0.85 | DRD2 (0.57) | DRD4DRD3DRD2MAPK14CYP2D6 | |
| SCHEMBL11140740 | 0.83 | DRD3 (0.43) | DRD4DRD3DRD2GAA | |
| SCHEMBL9046812 | 0.82 | KDM4E (0.51) | DRD4DRD3DRD2CYP2D6KDM4E | |
| SCHEMBL11134587 | 0.82 | DRD2 (0.43) | DRD4DRD3DRD2OPRL1 | |
| SCHEMBL11131756 | 0.82 | DRD3 (0.41) | DRD4DRD3DRD2MAPK14L3MBTL1 | |
| SCHEMBL7943354 | 0.79 | DRD3 (0.58) | DRD4DRD3DRD2MAPK14CYP2D6 | |
| SCHEMBL11131906 | 0.78 | ADRB1 (0.37) | DRD4DRD3DRD2OPRL1GAA |
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-0021924-B1 | INDOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1983-03-16 | — | — | EP | disclosed |
| US-4332808-A | Dopaminergically stimulating 4-substituted indoles | ROUSSEL UCLAF (FR) | 1982-06-01 | — | — | US | disclosed |
| EP-0021924-A2 | Indole derivatives, process for their preparation, their use as medicines and pharmaceutical compositions containing them | ROUSSEL-UCLAF (FR) | 1981-01-07 | — | — | EP | disclosed |