Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HPGDS | O60760 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9888403 | 0.78 | SMN1; SMN2 (0.48) | CHRM4CHRM5CHRM3CHRM2CHRM1 | |
| SCHEMBL29033641 | 0.73 | RAB9A (0.36) | MEN1KMT2ACYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL30778224 | 0.72 | ALOX5 (0.44) | MEN1KMT2ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL19419845 | 0.68 | CYP1A2 (0.47) | MEN1KMT2ACHRM4CHRM5CHRM3 | |
| SCHEMBL16115575 | 0.68 | CYP2C19 (0.42) | MEN1KMT2ACYP2C19HIF1APPARG | |
| SCHEMBL1974668 | 0.68 | KIF11 (0.48) | CYP3A4CYP2C9CYP2C19SMN1; SMN2ALDH1A1 | |
| SCHEMBL1035978 | 0.67 | ALDH1A1 (0.53) | MEN1KMT2ACYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8837045 | 0.66 | SIGMAR1 (0.50) | CHRM4CHRM5CHRM3CHRM2CHRM1 | |
| SCHEMBL30778197 | 0.66 | CYP19A1 (0.39) | MEN1KMT2ASMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL342721 | 0.65 | CCR9 (0.42) | MEN1KMT2ACYP3A4CYP2C19PPARG |
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-117603027-A | Olefin difunctional method and delta-trifluoromethyl ketone product prepared by same | 重庆理工大学 | 2024-02-27 | — | — | CN | disclosed |