Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 7/20 | 0.60 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | PARP1 | P09874 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 4/20 | 0.50 |
| ▸ | DRD3 | P35462 | 3/20 | 0.50 |
| ▸ | IDO1 | P14902 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | HBB | P68871 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8672012 | 0.84 | SIGMAR1 (0.56) | DRD4PARP1DRD2DRD3HRH3 | |
| SCHEMBL8875223 | 0.83 | PARP1 (0.58) | DRD4GAAHTTPARP1DRD2 | |
| SCHEMBL9396362 | 0.80 | HRH4 (0.51) | DRD4HRH4DRD2DRD3HRH3 | |
| SCHEMBL9392973 | 0.78 | HRH4 (0.49) | DRD4HRH4DRD2DRD3HRH3 | |
| SCHEMBL7866398 | 0.78 | DRD2 (0.61) | DRD4HTTPARP1DRD2DRD3 | |
| SCHEMBL1388197 | 0.75 | DRD4 (1.00) | DRD4GAAHTTPARP1DRD2 | |
| SCHEMBL30813284 | 0.75 | HRH4 (0.74) | HRH4HTTDRD2DRD3HRH3 | |
| SCHEMBL7052511 | 0.75 | HRH4 (0.74) | HRH4HTTDRD2DRD3HRH3 | |
| SCHEMBL8681808 | 0.75 | HRH4 (0.73) | DRD4HRH4DRD2DRD3HRH3 | |
| SCHEMBL1813854 | 0.74 | KDR (0.60) | DRD4HTTPARP1DRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994024105-A1 | INDOLE DERIVATIVES AS DOPAMINE D4 ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1994-10-27 | — | — | WO | claimed |
| US-5814644-A | Indole derivatives as dopamine D4 antagonists | MERCK SHARP & DOHME, LTD. (GB) | 1998-09-29 | — | — | US | disclosed |
| WO-1994024105-A1 | INDOLE DERIVATIVES AS DOPAMINE D4 ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 1994-10-27 | — | — | WO | disclosed |