Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL598833 | 0.84 | ACP3 (0.45) | ALDH1A1CYP2C9HPGDCYP2C19HTT | |
| SCHEMBL598832 | 0.84 | ACP3 (0.45) | ALDH1A1CYP2C9HPGDCYP2C19HTT | |
| SCHEMBL598411 | 0.83 | TACR3 (0.37) | ALDH1A1PPARGPPARAHPGDCYP2C19 | |
| SCHEMBL599733 | 0.78 | ALDH1A1 (0.45) | ALDH1A1PPARGPPARACYP2C9HPGD | |
| SCHEMBL17681407 | 0.73 | ALDH1A1 (0.41) | ALDH1A1PPARGPPARACYP2C9HPGD | |
| SCHEMBL17681408 | 0.73 | ALDH1A1 (0.41) | ALDH1A1PPARGPPARACYP2C9HPGD | |
| SCHEMBL3726388 | 0.73 | CYP1A2 (0.52) | CYP2C19 | |
| SCHEMBL598817 | 0.71 | SCN2A (0.43) | ALDH1A1PPARGPPARACYP2C9HPGD | |
| SCHEMBL598818 | 0.71 | SCN2A (0.43) | ALDH1A1PPARGPPARACYP2C9HPGD | |
| SCHEMBL17681454 | 0.71 | ALOX5 (0.40) | ALDH1A1PPARGPPARACYP2C9HPGD |
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-8115008-B2 | Method for producing optically active ester and method for producing optically active carboxylic acid | TOKYO UNIVERSITY OF SCIENCE EDUCATION FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) | 2012-02-14 | — | — | US | disclosed |