Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.36 |
| ▸ | PRCP | P42785 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 5/20 | 0.35 |
| ▸ | MAOA | P21397 | 4/20 | 0.35 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | FABP7 | O15540 | 1/20 | 0.35 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8323357 | 0.78 | TSHR (0.45) | TSHRSLC18A3TRPA1ALDH1A1GAA | |
| SCHEMBL8401759 | 0.76 | TSHR (0.37) | TSHRSLC18A3KDM1AMAOAMAOB | |
| SCHEMBL28766998 | 0.75 | SLC18A3 (0.55) | TSHRSLC18A3TRPA1ALDH1A1GAA | |
| SCHEMBL1535881 | 0.74 | SLC6A9 (0.43) | TSHRSLC18A3TRPA1SLC6A9KDM1A | |
| SCHEMBL8720460 | 0.74 | KDM1A (0.42) | TSHRSLC18A3TRPA1ALDH1A1GAA | |
| SCHEMBL23646574 | 0.72 | AKR1C1 (0.42) | TSHRSLC18A3TRPA1ALDH1A1GAA | |
| SCHEMBL151522 | 0.72 | TSHR (0.41) | TSHRSLC18A3TRPA1ALDH1A1GAA | |
| SCHEMBL3151033 | 0.72 | PRCP (0.49) | TSHRSLC18A3TRPA1SLC6A9PRCP | |
| SCHEMBL8424532 | 0.72 | TRPA1 (0.43) | SLC18A3TRPA1 | |
| SCHEMBL8720464 | 0.72 | KDM1A (0.41) | TRPA1SLC6A9KDM1AMAOAMAOB |
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-0351846-B1 | Phenylbicyclohexanol ester derivative | DAINIPPON INK & CHEMICALS (JP) | 1993-10-20 | — | — | EP | disclosed |
| EP-0351846-A3 | PHENYLBICYCLOHEXANOL ESTER DERIVATIVE | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1991-01-09 | — | — | EP | disclosed |
| EP-0351846-A2 | Phenylbicyclohexanol ester derivative | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1990-01-24 | — | — | EP | disclosed |