Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ELANE | P08246 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL290872 | 0.88 | HCAR2 (0.53) | NPC1RAB9ASMN1; SMN2ALOX5HCAR2 | |
| SCHEMBL8663566 | 0.79 | LMNA (0.62) | NPC1RAB9ASMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL3961218 | 0.77 | FFAR1 (0.64) | NPC1RAB9ASMN1; SMN2ELANEGAA | |
| SCHEMBL3935097 | 0.77 | LMNA (0.56) | NPC1RAB9ASMN1; SMN2MAPTTDP1 | |
| SCHEMBL12389249 | 0.77 | THRB (0.56) | NPC1RAB9ASMN1; SMN2KMT2AALDH1A1 | |
| SCHEMBL717987 | 0.76 | NPC1 (0.65) | NPC1RAB9ASMN1; SMN2ELANEGAA | |
| SCHEMBL111422 | 0.76 | ALDH1A1 (0.64) | NPC1RAB9ASMN1; SMN2ALOX5HCAR2 | |
| Acetic Acid Phenyl Ester SCHEMBL20524448 | 0.76 | ELANE (0.60) | ELANEGAAKMT2APTGS2ALDH1A1 | |
| SCHEMBL4351183 | 0.76 | ALDH1A1 (0.64) | NPC1RAB9ASMN1; SMN2ALOX5HCAR2 | |
| Benzene SCHEMBL19304565 | 0.76 | ALDH1A1 (0.64) | NPC1RAB9ASMN1; SMN2ALOX5HCAR2 |
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 |