Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.59 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | TACR1 | P25103 | 8/20 | 0.56 |
| ▸ | TACR3 | P29371 | 4/20 | 0.55 |
| ▸ | CCR2 | P41597 | 5/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8670444 | 0.88 | TACR1 (0.60) | SLC6A2SLC6A3RAB9ATACR1TACR3 | |
| SCHEMBL8675497 | 0.85 | TACR1 (0.57) | SLC6A2SLC6A3RAB9ATACR1TACR3 | |
| Hydrochloric Acid SCHEMBL11289779 | 0.78 | DRD3 (0.61) | RAB9ATACR1 | |
| SCHEMBL7934634 | 0.74 | TACR1 (0.69) | TACR1 | |
| SCHEMBL8674957 | 0.74 | CCR2 (0.54) | RAB9ATACR1TACR3CCR2 | |
| SCHEMBL8975616 | 0.73 | RAB9A (0.94) | SLC6A2SLC6A3RAB9A | |
| Hydrochloric Acid SCHEMBL11636520 | 0.73 | RAB9A (1.00) | SLC6A2SLC6A3RAB9A | |
| SCHEMBL8672849 | 0.73 | CYP1A2 (0.47) | TACR1TACR3CCR2 | |
| SCHEMBL11282126 | 0.69 | DRD3 (0.60) | TACR1TACR3 | |
| SCHEMBL14587333 | 0.67 | DRD2 (0.61) | SLC6A2SLC6A3 |
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-5708006-A | ANTIINFLAMMATORY AGENTS | BOEHRINGER INGELHEIM KG (DE) | 1998-01-13 | — | — | US | disclosed |
| US-5696123-A | ALPHA-PIPERAZINYL BENZYL COMPOUND AS TACHYKININ ANTAGONIST TREATING ASTHMA, BRONCHITIS, SKIN DISORDER, EYE DISEASE, HEADACHE, GASTROINTESTINAL DISORDER | BOEHRINGER INGELHEIM KG (DE) | 1997-12-09 | — | — | US | disclosed |