Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ECE1 | P42892 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.38 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Isovaleramide SCHEMBL9271798 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TDP1CA2GAAHTT | |
| Isovaleramide SCHEMBL6055503 | 0.91 | ALDH1A1 (0.53) | ALDH1A1TDP1CA2SLC7A5CYP2C19 | |
| Isovaleramide SCHEMBL9641 | 0.91 | — | — | |
| Isovaleramide SCHEMBL28439595 | 0.89 | ALDH1A1 (0.52) | ALDH1A1TDP1CA2GAAHTT | |
| Isovaleramide SCHEMBL28163028 | 0.88 | — | — | |
| Isovaleramide SCHEMBL9846971 | 0.88 | — | — | |
| Isovaleramide SCHEMBL1650316 | 0.88 | — | — | |
| Isovaleramide SCHEMBL7081542 | 0.88 | — | — | |
| Isovaleramide SCHEMBL28203252 | 0.87 | TDP1 (0.38) | ALDH1A1TDP1CA2GAAHTT | |
| Isovaleramide SCHEMBL28666959 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TDP1CA2GAAHTT |
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-107406636-A | Resin Additive Masterbatch | 株式会社ADEKA | 2017-11-28 | — | — | CN | disclosed |