Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.42 |
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | METAP1 | P53582 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8120419 | 0.90 | AKR1B1 (0.51) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C9 | |
| SCHEMBL15641295 | 0.90 | AKR1B1 (0.51) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C9 | |
| SCHEMBL448107 | 0.90 | AKR1B1 (0.51) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C9 | |
| SCHEMBL27890998 | 0.88 | AKR1B1 (0.50) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C9 | |
| SCHEMBL600007 | 0.83 | AKR1B1 (0.47) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C19 | |
| SCHEMBL2204495 | 0.80 | PTGS2 (0.56) | AKR1C3AKR1C2ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL599642 | 0.80 | CYP2C9 (0.43) | ALDH1A1CYP2C9CYP2C19HPGDHTT | |
| SCHEMBL28241058 | 0.79 | ALDH1A1 (0.48) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C9 | |
| SCHEMBL15695555 | 0.79 | ALDH1A1 (0.48) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C9 | |
| SCHEMBL7821462 | 0.78 | AKR1B1 (0.48) | AKR1B1AKR1C3AKR1C2ALDH1A1CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-9315442-B2 | Method for manufacturing optically active carboxylic acid ester | TOKYO UNIVERSITY OF SCIENCE EDUCATIONAL FOUNDATION ADMINISTRATIVE ORGANIZATION (JP) | 2016-04-19 | — | — | US | disclosed |
| 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 |