Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | F2 | P00734 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6205556 | 0.99 | HRH3 (0.59) | HRH3ALDH1A1POLBMAPTNPC1 | |
| SCHEMBL6205238 | 0.91 | NPC1 (0.55) | HRH3ALDH1A1POLBMAPTNPC1 | |
| Hydrochloric Acid SCHEMBL6206718 | 0.90 | NPC1 (0.54) | HRH3ALDH1A1POLBMAPTNPC1 | |
| SCHEMBL6205197 | 0.88 | POLB (0.61) | ALDH1A1POLBMAPTNPC1RAB9A | |
| SCHEMBL6206000 | 0.88 | HRH3 (0.53) | HRH3ALDH1A1POLBMAPTNPC1 | |
| Hydrochloric Acid SCHEMBL6208393 | 0.87 | HRH3 (0.53) | HRH3ALDH1A1POLBMAPTNPC1 | |
| SCHEMBL6983693 | 0.86 | HPGD (0.55) | ALDH1A1POLBMAPTNPC1RAB9A | |
| SCHEMBL6206009 | 0.85 | HPGD (0.58) | HRH3ALDH1A1POLBMAPTNPC1 | |
| SCHEMBL6204682 | 0.85 | TSHR (0.61) | ALDH1A1POLBMAPTF2HSD17B10 | |
| Hydrochloric Acid SCHEMBL6206697 | 0.84 | TSHR (0.60) | ALDH1A1POLBMAPTF2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177177-B1 | SUBSTITUTED 4-OXO-QUINOLINE-3-CARBOXAMIDES: GABA BRAIN RECEPTOR LIGANDS | NEUROGEN CORP (US) | 2005-02-23 | — | — | EP | claimed |
| US-6413956-B1 | AGONISTS, ANTAGONISTS OR INVERSE AGONISTS AND LOCALIZATION PROBES FOR GAMMA AMINOBUTYRIC ACID BRAIN RECEPTORS; ANXIETY, DEPRESSION, DOWN SYNDROME, SLEEP AND SEIZURE DISORDERS, OVERDOSE WITH BENZODIAZEPINE DRUGS AND MEMORY ENHANCEMENT | NEUROGEN CORPORATION | 2002-07-02 | — | — | US | claimed |