Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | FGB | P02675 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.50 |
| ▸ | PPARG | P37231 | 1/20 | 0.50 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.50 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | RPS6KA2 | Q15349 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18338826 | 0.87 | NFE2L2 (0.48) | ALDH1A1TDP1MEN1KMT2ARAB9A | |
| SCHEMBL3786465 | 0.85 | ALDH1A1 (0.59) | ALDH1A1TDP1ADRA2BPTGS1MEN1 | |
| SCHEMBL29121522 | 0.81 | ALDH1A1 (0.53) | ALDH1A1TDP1ADRA2BPTGS1MEN1 | |
| SCHEMBL397261 | 0.80 | ALDH1A1 (0.61) | ALDH1A1TDP1ADRA2BPTGS1MEN1 | |
| SCHEMBL22760437 | 0.79 | DHPS (0.44) | ALDH1A1TDP1MEN1KMT2AMAPT | |
| SCHEMBL30816756 | 0.79 | ALDH1A1 (0.65) | ALDH1A1TDP1ADRA2BPTGS1MEN1 | |
| SCHEMBL7276398 | 0.79 | ALDH1A1 (0.65) | ALDH1A1TDP1ADRA2BPTGS1MEN1 | |
| SCHEMBL17842499 | 0.79 | TAAR1 (0.49) | ALDH1A1TDP1KMT2ARAB9AMAPT | |
| SCHEMBL31607650 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1MEN1 | |
| SCHEMBL27185986 | 0.79 | ALDH1A1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105164104-B | Urea derivative and its purposes as fatty acid binding protein (FABP) inhibitor | 豪夫迈·罗氏有限公司 | 2019-04-12 | — | — | CN | disclosed |