Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | TDO2 | P48775 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 2/20 | 0.40 |
| ▸ | KLK1 | P06870 | 2/20 | 0.40 |
| ▸ | KLK6 | Q92876 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL7949802 | 0.91 | NPC1 (0.47) | TRPA1NPC1RAB9AIDO1TDO2 | |
| SCHEMBL7949070 | 0.87 | NPC1 (0.44) | TRPA1NPC1RAB9AIDO1TDO2 | |
| SCHEMBL3174922 | 0.78 | NPC1 (0.66) | TRPA1NPC1RAB9AIDO1TDO2 | |
| SCHEMBL7953589 | 0.77 | TRPA1 (0.52) | TRPA1NPC1RAB9AIDO1TDO2 | |
| SCHEMBL686122 | 0.72 | TRPA1 (0.52) | TRPA1NPC1RAB9AIDO1TDO2 | |
| Alcohol SCHEMBL28657036 | 0.72 | TRPA1 (0.80) | TRPA1ALOX15TP53TDP1LMNA | |
| Acetic Acid SCHEMBL7951790 | 0.71 | CSNK2A1 (0.50) | TRPA1NPC1RAB9AIDO1TDO2 | |
| SCHEMBL12388 | 0.70 | — | — | |
| SCHEMBL29406334 | 0.70 | — | — | |
| SCHEMBL1758035 | 0.70 | NPC1 (0.56) | TRPA1NPC1RAB9AIDO1TDO2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6255517-B1 | 6-SULFONYLOXYISOPROPENYL-M-CRESOL AND ESTERS | Zee, Ok Pyo (KR) | 2001-07-03 | — | — | US | disclosed |