Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 2/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27588556 | 0.79 | MAOA (0.47) | CYP3A4CASP1RECQL | |
| SCHEMBL27606396 | 0.78 | CYP3A4 (0.41) | ALDH1A1CYP3A4TP53ALOX15MAPK1 | |
| SCHEMBL27588471 | 0.75 | MAOA (0.40) | CYP3A4CASP1RECQL | |
| SCHEMBL8659969 | 0.74 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL2777570 | 0.74 | ALDH1A1 (0.39) | ALDH1A1CYP3A4TP53ALOX15MAPK1 | |
| SCHEMBL27588652 | 0.74 | CYP3A4 (0.47) | ALDH1A1CYP3A4TP53ALOX15MAPK1 | |
| SCHEMBL7423522 | 0.73 | APP (0.33) | — | |
| SCHEMBL10605495 | 0.73 | TAAR1 (0.31) | ALDH1A1MAPK1 | |
| SCHEMBL196542 | 0.73 | KMT2A (0.36) | — | |
| SCHEMBL644833 | 0.72 | — | — |
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-106999478-A | It is used as the Diarylurea derivatives of P38 kinase inhibitors | 瑞斯比维特有限公司 | 2017-08-01 | — | — | CN | disclosed |