Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.51 |
| ▸ | HTR2C | P28335 | 4/20 | 0.51 |
| ▸ | HTR2B | P41595 | 4/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 3/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11388368 | 0.89 | DRD2 (0.49) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL11379392 | 0.86 | DRD2 (0.53) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL11377792 | 0.85 | DRD3 (0.55) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL11382615 | 0.84 | HTR2A (0.45) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL11381185 | 0.83 | ALDH1A1 (0.49) | HTR2AHTR2CHTR2BALDH1A1ALDH3A1 | |
| SCHEMBL11383963 | 0.83 | HTR2A (0.49) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL11377237 | 0.80 | HTR2A (0.57) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL14567549 | 0.77 | HTR2A (0.51) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| SCHEMBL13939941 | 0.77 | HTR2A (0.51) | HTR2AHTR2CHTR2BDRD2DRD3 | |
| Ethylamine SCHEMBL11390349 | 0.76 | HTR2A (0.45) | HTR2AHTR2CHTR2BALDH1A1CYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4273773-A | IN COMBINATION WITH A DIURETIC | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-06-16 | — | — | US | claimed |
| US-4273773-A | IN COMBINATION WITH A DIURETIC | AMERICAN HOME PRODUCTS CORPORATION (US) | 1981-06-16 | — | — | US | disclosed |