Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.40 |
| ▸ | PRCP | P42785 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL6277434 | 0.84 | HTR1A (0.41) | HTR1APDPK1DRD2MAOAMAOB | |
| SCHEMBL19838830 | 0.80 | PDPK1 (0.47) | PDPK1MAOAMAOBBCHEADRA2B | |
| SCHEMBL6883953 | 0.79 | HTR2A (0.44) | PDPK1DRD2ADRA2BADRA2CADRA1A | |
| SCHEMBL8298173 | 0.78 | PPARA (0.53) | — | |
| SCHEMBL7678037 | 0.77 | PDPK1 (0.44) | PDPK1MAOAMAOBBCHEADRA2B | |
| Methyl Alcohol SCHEMBL14815578 | 0.77 | PRCP (0.49) | PDPK1SIGMAR1PRCPIDO1 | |
| SCHEMBL9499564 | 0.77 | IDO1 (0.47) | PDPK1HTR6IDO1 | |
| SCHEMBL3394128 | 0.76 | CARM1 (0.46) | PDPK1 | |
| SCHEMBL11031060 | 0.76 | PDPK1 (0.43) | PDPK1DRD2MAOAMAOBBCHE | |
| SCHEMBL30298334 | 0.76 | PRCP (0.52) | PDPK1SIGMAR1PRCPIDO1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4308412-A | Indane alkanols and tricyclic isochromans and organoleptic uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1981-12-29 | — | — | US | disclosed |
| US-4265818-A | FOOD FLAVORINGS OR PERFUME COSTNETIC AROMAS | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1981-05-05 | — | — | US | disclosed |