Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | DRD1 | P21728 | 17/20 | 0.52 |
| ▸ | DRD2 | P14416 | 10/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.52 |
| ▸ | DRD5 | P21918 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | THPO | P40225 | 2/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | BLM | P54132 | 2/20 | 0.51 |
| ▸ | GFER | P55789 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11286208 | 0.89 | TAAR1 (0.55) | TAAR1DRD1DRD2KDM4EMAPT | |
| SCHEMBL458574 | 0.80 | GID4 (0.62) | DRD1DRD2CYP3A4CYP2D6RECQL | |
| SCHEMBL16835251 | 0.76 | HTR2C (0.61) | TAAR1DRD1DRD2KDM4EMAPT | |
| SCHEMBL11294418 | 0.76 | TAAR1 (0.55) | TAAR1DRD1DRD2KDM4EMAPT | |
| Bromide SCHEMBL16241877 | 0.75 | HTR2C (0.60) | TAAR1DRD1DRD2KDM4EMAPT | |
| SCHEMBL11540905 | 0.71 | DRD1 (0.53) | TAAR1DRD1DRD2KDM4EMAPT | |
| SCHEMBL2566292 | 0.70 | TAAR1 (0.97) | TAAR1DRD1DRD2KDM4EMAPT | |
| Maleic Acid SCHEMBL8147693 | 0.70 | TAAR1 (0.76) | TAAR1DRD1DRD2KDM4EMAPT | |
| Fumaric Acid SCHEMBL8147697 | 0.70 | TAAR1 (0.76) | TAAR1DRD1DRD2KDM4EMAPT | |
| SCHEMBL11542130 | 0.69 | DRD1 (0.70) | TAAR1DRD1DRD2KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4165372-A | 6-Carboxy-1-phenyl-2,3,4,5-tetrahydro-1H-3-benzazepine compounds and use as dopaminergic agents | SMITHKLINE CORPORATION (US) | 1979-08-21 | — | — | US | disclosed |