Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ME2 | P23368 | 1/20 | 0.39 |
| ▸ | ME1 | P48163 | 1/20 | 0.39 |
| ▸ | ME3 | Q16798 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27704794 | 0.91 | ALDH1A1 (0.43) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27515368 | 0.89 | ALDH1A1 (0.35) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27452198 | 0.84 | ALDH1A1 (0.47) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27847437 | 0.81 | CYP1A2 (0.43) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27661280 | 0.79 | ALDH1A1 (0.61) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27780588 | 0.79 | ALDH1A1 (0.49) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL28323555 | 0.79 | CYP2C19 (0.41) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL28323553 | 0.79 | ALDH1A1 (0.41) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27810256 | 0.78 | ALDH1A1 (0.59) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 | |
| SCHEMBL27304277 | 0.77 | ALDH1A1 (0.53) | ALDH1A1HSD17B10KDM4EMEN1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104837814-B | Novel compound and use thereof | 拜欧斯戴特斯公司 | 2018-04-17 | — | — | CN | disclosed |
| CN-104837814-A | Novel compound and use thereof | BIOSTATUS LTD | 2015-08-12 | — | — | CN | disclosed |