Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.64 |
| ▸ | DRD3 | P35462 | 2/20 | 0.64 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.63 |
| ▸ | HTR1D | P28221 | 1/20 | 0.61 |
| ▸ | HTR1B | P28222 | 1/20 | 0.61 |
| ▸ | CDK4 | P11802 | 2/20 | 0.60 |
| ▸ | CCND1 | P24385 | 2/20 | 0.60 |
| ▸ | ACHE | P22303 | 1/20 | 0.60 |
| ▸ | HTR1A | P08908 | 1/20 | 0.57 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.56 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.56 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.56 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11849183 | 0.91 | DRD2 (0.58) | DRD2DRD3NPC1POLBRAB9A | |
| SCHEMBL11841997 | 0.89 | ADRA2A (0.70) | DRD2DRD3NPC1RAB9AHTR1D | |
| SCHEMBL11841817 | 0.88 | ADRA2A (0.60) | DRD2DRD3NPC1RAB9AHTR1D | |
| SCHEMBL11848458 | 0.87 | CDK4 (0.59) | DRD2DRD3HTR1DHTR1BCDK4 | |
| SCHEMBL11840670 | 0.87 | SIRT1 (0.61) | DRD2DRD3HTR1DHTR1BCDK4 | |
| SCHEMBL11841837 | 0.86 | ADRA2A (0.56) | DRD2DRD3NPC1RAB9AHTR1D | |
| SCHEMBL11843383 | 0.86 | MEN1 (0.52) | DRD2DRD3HTR1DHTR1BACHE | |
| Hydrochloric Acid SCHEMBL11837443 | 0.85 | ADRA2A (0.56) | DRD2DRD3NPC1RAB9AHTR1D | |
| SCHEMBL11848772 | 0.85 | TRPV1 (0.62) | DRD2DRD3HTR1DHTR1BCDK4 | |
| SCHEMBL11860457 | 0.85 | ADRA2A (0.59) | DRD2DRD3NPC1RAB9AHTR1D |
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-3997539-A | HYPOTENSIVE, TRANQUILIZER | AMERICAN HOECHST CORPORATION (US) | 1976-12-14 | — | — | US | disclosed |