Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | GLA | P06280 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18758669 | 0.81 | ALOX15 (0.43) | CDK1CCNB1ALOX15ALDH1A1KDM4E | |
| SCHEMBL18758774 | 0.80 | GPR35 (0.54) | ALOX15GPR35ALDH1A1KDM4EHPGD | |
| SCHEMBL11640545 | 0.78 | GPR35 (0.64) | CDK1CCNB1ALOX15GPR35ALDH1A1 | |
| SCHEMBL11190882 | 0.74 | CDK1 (0.70) | CDK1CCNB1ALOX15ALDH1A1KDM4E | |
| SCHEMBL11180617 | 0.71 | GAA (0.54) | CDK1CCNB1ALDH1A1KDM4EHPGD | |
| SCHEMBL10478330 | 0.71 | ALOX15 (0.49) | CDK1CCNB1ALOX15ALDH1A1KDM4E | |
| SCHEMBL5639156 | 0.70 | ALOX15 (0.69) | ALOX15ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL11198920 | 0.70 | ALOX15 (0.65) | ALOX15ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL24190132 | 0.69 | CDK1 (0.48) | CDK1CCNB1ALOX15ALDH1A1KDM4E | |
| SCHEMBL30402891 | 0.69 | CDK1 (0.48) | CDK1CCNB1ALOX15ALDH1A1KDM4E |
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-2017065899-A1 | DEUTERATED CHLOROKYNURENINES FOR THE TREATMENT OF NEUROPSYCHIATRIC DISORDERS | AUSPEX PHARMACEUTICALS, INC. (US) | 2017-04-20 | — | — | WO | disclosed |