Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9692374 | 1.00 | HTT (0.48) | HTTNPC1RAB9AHTR1AMTNR1A | |
| SCHEMBL9692918 | 1.00 | HTT (0.48) | HTTNPC1RAB9AHTR1AMTNR1A | |
| SCHEMBL9692907 | 1.00 | HTT (0.48) | HTTNPC1RAB9AHTR1AMTNR1A | |
| Hydrochloric Acid SCHEMBL9692554 | 0.99 | HTT (0.47) | HTTNPC1RAB9AHTR1AMTNR1A | |
| Hydrochloric Acid SCHEMBL9692561 | 0.99 | HTT (0.47) | HTTNPC1RAB9AHTR1AMTNR1A | |
| Fumaric Acid SCHEMBL9691873 | 0.94 | HTT (0.46) | HTTHTR1AALDH1A1 | |
| Fumaric Acid SCHEMBL9691879 | 0.94 | HTT (0.46) | HTTHTR1AALDH1A1 | |
| SCHEMBL9692630 | 0.90 | HTT (0.46) | HTTNPC1RAB9AHTR1AMTNR1A | |
| SCHEMBL9692643 | 0.90 | HTT (0.46) | HTTNPC1RAB9AHTR1AMTNR1A | |
| SCHEMBL9826865 | 0.84 | MTNR1A (0.45) | HTTNPC1RAB9AHTR1AMTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0252005-B1 | HYDROGENATED 1-BENZOOXACYCLOALKYL-PYRIDINE CARBOXYLIC-ACID COMPOUNDS | CIBA-GEIGY AG (CH) | 1991-07-10 | — | — | EP | claimed |
| US-5112855-A | Nootropic Agents | CIBA-GEIGY CORPORATION (US) | 1992-05-12 | — | — | US | disclosed |
| US-4957928-A | NOOTROPIC AGENTS, COGNITION ACTIVATORS | CIBA-GEIGY CORPORATION (US) | 1990-09-18 | — | — | US | disclosed |