Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | XIAP | P98170 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10414813 | 1.00 | CYP3A4 (0.31) | CYP3A4XIAPALDH1A1BLMKMT2A | |
| SCHEMBL10412836 | 0.91 | NR1I2 (0.32) | CYP3A4XIAPALDH1A1BLMKMT2A | |
| SCHEMBL10412840 | 0.90 | HSD17B10 (0.40) | CYP3A4ALDH1A1BLMKMT2ACYP2C19 | |
| SCHEMBL10551840 | 0.85 | KMT2A (0.42) | ALDH1A1KMT2AMAPK1 | |
| SCHEMBL10413872 | 0.84 | MAPK1 (0.38) | CYP3A4ALDH1A1CYP2C19MAPK1 | |
| SCHEMBL10413404 | 0.82 | MAPT (0.39) | KMT2AHSD17B10MAPTTDP1 | |
| SCHEMBL10414816 | 0.79 | KDM4E (0.33) | KMT2AHSD17B10TDP1 | |
| SCHEMBL10414276 | 0.79 | TYMP (0.30) | — | |
| SCHEMBL10414809 | 0.79 | MEN1 (0.35) | KMT2AHSD17B10MAPTTDP1 | |
| SCHEMBL10414278 | 0.78 | POLB (0.38) | ALDH1A1BLMKMT2AHSD17B10MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4912214-A | Containing azelidin-2-one ring | HOFFMAN-LA ROCHE INC. (US) | 1990-03-27 | — | — | US | disclosed |