Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | PGR | P06401 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9547863 | 1.00 | ESR1 (0.46) | ESR1OPRM1LMNACHRM1SLC6A2 | |
| SCHEMBL14258829 | 0.93 | HCAR2 (0.40) | ESR1LMNATDP1MAPTALDH1A1 | |
| SCHEMBL2740694 | 0.86 | ACHE (0.41) | LMNATDP1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL28265857 | 0.85 | KLK7 (0.40) | LMNATDP1CYP1A2MAPTCYP2C9 | |
| SCHEMBL13704203 | 0.85 | ALDH1A1 (0.43) | LMNATDP1CYP1A2CYP2D6MAPT | |
| SCHEMBL872787 | 0.84 | HCAR2 (0.51) | LMNACHRM1CYP1A2CHRM2CYP2D6 | |
| SCHEMBL9329235 | 0.83 | MAPT (0.50) | MAPTCA1CA2ALDH1A1TSHR | |
| SCHEMBL9329240 | 0.83 | MAPT (0.50) | MAPTCA1CA2ALDH1A1TSHR | |
| SCHEMBL2740617 | 0.83 | AKR1C3 (0.43) | TDP1MAPTPTGS1HSD17B10ALDH1A1 | |
| SCHEMBL2740659 | 0.82 | MAPT (0.50) | CYP1A2MAPTCYP2C9CYP2C19PDCD1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0288297-B1 | OPTICALLY ACTIVE BENZENE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-03-17 | — | — | EP | disclosed |
| US-4985590-A | Optically active benzene derivatives and process for preparation thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1991-01-15 | — | — | US | disclosed |
| EP-0288297-A2 | Optically active benzene derivatives and process for preparation thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-10-26 | — | — | EP | disclosed |