Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.86 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.77 |
| ▸ | ESR1 | P03372 | 4/20 | 0.77 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.77 |
| ▸ | TSHR | P16473 | 3/20 | 0.77 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.77 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.77 |
| ▸ | KDR | P35968 | 1/20 | 0.77 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.62 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.62 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Propylparaben SCHEMBL1903370 | 0.95 | ALDH1A1 (0.86) | LMNAALDH1A1ESR1TDP1TSHR | |
| SCHEMBL130761 | 0.93 | LMNA (1.00) | LMNAALDH1A1ESR1TDP1TSHR | |
| SCHEMBL7181498 | 0.93 | LMNA (1.00) | LMNAALDH1A1ESR1TDP1TSHR | |
| Hydrochloric Acid SCHEMBL27605432 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR | |
| SCHEMBL4465574 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR | |
| Methane SCHEMBL28760616 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR | |
| SCHEMBL28387455 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR | |
| SCHEMBL30886680 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR | |
| Water SCHEMBL28012190 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR | |
| Methyl Alcohol SCHEMBL28069166 | 0.91 | LMNA (0.96) | LMNAALDH1A1ESR1TDP1TSHR |
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-102905527-B | Nicotinic acetylcholine receptor modulators | 阿斯特来亚治疗有限责任公司 | 2016-08-24 | — | — | CN | disclosed |