Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.48 |
| ▸ | SYK | P43405 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.44 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2169026 | 0.78 | CNR2 (0.64) | RAB9ACYP1A2SYKALDH1A1CNR2 | |
| SCHEMBL28940962 | 0.77 | ALDH1A1 (0.55) | RAB9ACYP1A2ALDH1A1CNR2NPC1 | |
| SCHEMBL6630091 | 0.73 | CTNNB1 (0.59) | RAB9ACTNNB1KDM4ELMNAMAPT | |
| SCHEMBL6628177 | 0.73 | CTNNB1 (0.59) | RAB9ACTNNB1KDM4ELMNASMN1; SMN2 | |
| SCHEMBL357927 | 0.73 | ALDH1A1 (0.71) | CYP1A2ALDH1A1KDM4EPOLBHPGD | |
| SCHEMBL27766592 | 0.72 | ALDH1A1 (0.55) | RAB9ACYP1A2ALDH1A1CNR2NPC1 | |
| SCHEMBL2852915 | 0.72 | ALDH1A1 (0.55) | RAB9ACYP1A2ALDH1A1CNR2NPC1 | |
| Hydrochloric Acid SCHEMBL5013604 | 0.72 | ALDH1A1 (0.69) | CYP1A2ALDH1A1KDM4EPOLBHPGD | |
| SCHEMBL5739985 | 0.71 | PKM (0.51) | RAB9ACYP1A2ALDH1A1NPC1AKT1 | |
| SCHEMBL6628686 | 0.71 | CTNNB1 (0.56) | RAB9ACYP1A2CTNNB1NPC1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002016357-A2 | QUINUCLIDINE-SUBSTITUTED ARYL MOIETIES FOR TREATMENT OF DISEASE (NICOTINIC ACETYLCHOLINE RECEPTOR LIGANDS) | PHARMACIA & UPJOHN COMPANY (US) | 2002-02-28 | — | — | WO | claimed |