Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | PLAU | P00749 | 1/20 | 0.50 |
| ▸ | ELANE | P08246 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Phenylacetic Acid SCHEMBL30136468 | 0.88 | AKR1B1 (0.63) | ALDH1A1PTGS1HTTCTBP2AKR1B1 | |
| SCHEMBL12384217 | 0.84 | CA2 (0.57) | KDM4EPOLBALDH1A1MAPTPTGS1 | |
| SCHEMBL6342 | 0.83 | IDO1 (0.55) | POLBNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| Iodide SCHEMBL9356671 | 0.81 | IDO1 (0.53) | POLBNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL28552476 | 0.81 | IDO1 (0.53) | POLBNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL28560899 | 0.81 | IDO1 (0.53) | POLBNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL240822 | 0.81 | KDM4E (0.74) | KDM4EPOLBNPC1ALDH1A1RAB9A | |
| Hydrochloric Acid SCHEMBL2022863 | 0.79 | KDM4E (0.72) | KDM4EPOLBNPC1ALDH1A1RAB9A | |
| Hydrogen Sulfide SCHEMBL29062416 | 0.79 | KDM4E (0.72) | KDM4EPOLBNPC1ALDH1A1RAB9A | |
| SCHEMBL27952524 | 0.79 | KDM4E (0.72) | KDM4EPOLBNPC1ALDH1A1RAB9A |
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-108601958-A | Pro-perfume compositions | 爱客多有限公司 | 2018-09-28 | — | — | CN | disclosed |