Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.58 |
| ▸ | PPARG | P37231 | 2/20 | 0.48 |
| ▸ | PPARA | Q07869 | 2/20 | 0.48 |
| ▸ | CPA1 | P15085 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.43 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.43 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.43 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.43 |
| ▸ | ALB | P02768 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14946403 | 0.83 | TRPA1 (0.63) | TRPA1CPA1KMT2APTGS1CYP2C9 | |
| SCHEMBL8289807 | 0.83 | TRPA1 (0.63) | TRPA1CPA1KMT2APTGS1CYP2C9 | |
| SCHEMBL11828527 | 0.82 | PTGS1 (0.51) | TRPA1KMT2APTGS1PTGS2CYP2C9 | |
| SCHEMBL1515224 | 0.79 | PPARA (0.53) | TRPA1PPARGPPARACPA1KMT2A | |
| SCHEMBL6005381 | 0.79 | PPARA (0.53) | TRPA1PPARGPPARACPA1KMT2A | |
| SCHEMBL11830999 | 0.79 | PPARG (0.51) | PPARGPPARACPA1AKR1C2MME | |
| Cadaverine Tartrate SCHEMBL9773333 | 0.79 | TAAR1 (0.50) | TRPA1PPARGPPARACPA1KMT2A | |
| SCHEMBL11825730 | 0.78 | MME (0.47) | TRPA1PPARGPPARACPA1KMT2A | |
| SCHEMBL4991167 | 0.78 | TRPA1 (0.53) | TRPA1PPARGPPARACPA1KMT2A | |
| Hydrochloric Acid SCHEMBL25382025 | 0.77 | PPARG (0.47) | TRPA1PPARGPPARACPA1PTGS1 |
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-105980387-A | Serine/threonine kinase inhibitors | 阵列生物制药公司 | 2016-09-28 | — | — | CN | disclosed |