Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | PPID | Q08752 | 2/20 | 0.46 |
| ▸ | PPIB | P23284 | 1/20 | 0.46 |
| ▸ | PPIA | P62937 | 1/20 | 0.46 |
| ▸ | PPIG | Q13427 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.45 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Ethyl Propionate SCHEMBL27988302 | 0.87 | SMN1; SMN2 (0.49) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| Aniline SCHEMBL27466974 | 0.85 | LMNA (0.49) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| Aniline SCHEMBL28279568 | 0.85 | SMN1; SMN2 (0.51) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| Ethyl Propionate SCHEMBL27658259 | 0.84 | MEN1 (0.52) | LMNAALDH1A1MEN1KMT2AGAA | |
| Biphenyl SCHEMBL7178640 | 0.84 | SMN1; SMN2 (0.52) | LMNAALDH1A1HSD17B10MEN1KMT2A | |
| Ethyl Propionate SCHEMBL11288186 | 0.83 | GAA (0.57) | LMNACYP1A2ALDH1A1HSD17B10MEN1 | |
| Ethyl Propionate SCHEMBL6266819 | 0.82 | GAA (0.53) | ALDH1A1MEN1KMT2AGAATSHR | |
| Aniline SCHEMBL5361774 | 0.82 | ALDH1A1 (0.56) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| Aniline SCHEMBL27427225 | 0.82 | POLB (0.46) | LMNACYP1A2CYP3A4MAOAALDH1A1 | |
| Aniline SCHEMBL28348599 | 0.82 | POLB (0.46) | LMNACYP1A2CYP3A4MAOAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1735408-A | Receptor function controlling agent | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2006-02-15 | — | — | CN | disclosed |
| CN-1089614-A | Alpha-phosphonosulfonate squalene synthetase inhibitors and method | SQUIBB & SONS INC (US) | 1994-07-20 | — | — | CN | disclosed |