Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 7/20 | 0.59 |
| ▸ | ESR1 | P03372 | 6/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.50 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | ESRRG | P62508 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9350713 | 1.00 | ESR2 (0.59) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL15911925 | 0.86 | SLC18A3 (0.57) | SLC18A3TRPV6PGRALDH1A1MAPT | |
| SCHEMBL1066991 | 0.86 | SLC18A3 (0.57) | SLC18A3TRPV6PGRALDH1A1MAPT | |
| SCHEMBL9347450 | 0.83 | TRPV6 (0.47) | ESR2ESR1CYP3A4CYP2C9SLC18A3 | |
| SCHEMBL9347444 | 0.83 | TRPV6 (0.47) | ESR2ESR1CYP3A4CYP2C9SLC18A3 | |
| SCHEMBL3539037 | 0.83 | DGAT1 (0.48) | SLC18A3TRPV6PGRALDH1A1 | |
| SCHEMBL3539040 | 0.83 | DGAT1 (0.48) | SLC18A3TRPV6PGRALDH1A1 | |
| SCHEMBL9351302 | 0.81 | SLC18A3 (0.46) | ESR2ESR1CYP3A4CYP2C9SLC18A3 | |
| SCHEMBL9351306 | 0.81 | SLC18A3 (0.46) | ESR2ESR1CYP3A4CYP2C9SLC18A3 | |
| SCHEMBL3302063 | 0.81 | SLC18A3 (0.61) | ESR2SLC18A3TRPV6PGRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0272580-B1 | Liquidcrystalline cyclohexylbenzene derivatives their manufacturing and novel nematic admixtures containing same | WOJSKOWA AKAD TECH (PL) | 1994-08-17 | — | — | EP | disclosed |
| EP-0272580-A2 | Liquidcrystalline cyclohexylbenzene derivatives their manufacturing and novel nematic admixtures containing same | Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) | 1988-06-29 | — | — | EP | disclosed |