Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.67 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.56 |
| ▸ | DRD4 | P21917 | 6/20 | 0.55 |
| ▸ | DRD3 | P35462 | 4/20 | 0.55 |
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.55 |
| ▸ | HTR3A | P46098 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL9872858 | 1.00 | DRD2 (0.67) | DRD2HTR4DRD4DRD3ACHE | |
| SCHEMBL9872901 | 0.82 | POLB (0.49) | DRD2DRD4DRD3KCNH2 | |
| SCHEMBL9872897 | 0.82 | POLB (0.49) | DRD2DRD4DRD3KCNH2 | |
| SCHEMBL9872909 | 0.81 | DRD2 (0.46) | DRD2DRD4DRD3OPRK1HTR3A | |
| SCHEMBL11094874 | 0.78 | DRD2 (0.61) | DRD2DRD4DRD3ACHECYP1A2 | |
| SCHEMBL11093546 | 0.77 | DRD2 (0.60) | DRD2DRD4DRD3ACHECYP1A2 | |
| SCHEMBL7444398 | 0.76 | HTR4 (0.55) | HTR4CYP3A4 | |
| SCHEMBL7444394 | 0.76 | HTR4 (0.55) | HTR4CYP3A4 | |
| SCHEMBL11237006 | 0.76 | DRD2 (0.83) | DRD2HTR4DRD4DRD3ACHE | |
| SCHEMBL11228982 | 0.76 | DRD2 (0.83) | DRD2HTR4DRD4DRD3ACHE |
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 |
|---|---|---|---|---|---|---|---|
| US-5017582-A | Analgesics | SANDOZ LTD. (CH) | 1991-05-21 | — | — | US | disclosed |
| US-4910207-A | Antipsychotic agent | NOVARTIS AG (CH) | 1990-03-20 | — | — | US | disclosed |
| US-4803199-A | SEROTONIN ANTAGONIST, ANALGESIC ANTIARRHYTHMIC AGENTS | NOVARTIS AG (CH) | 1989-02-07 | — | — | US | disclosed |