Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 3/20 | 0.72 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.45 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11613701 | 0.89 | TRPA1 (0.68) | TRPA1CYP2D6CSNK1ESIGMAR1TAAR1 | |
| Hydrochloric Acid SCHEMBL9346955 | 0.84 | CSNK1E (0.68) | TRPA1CYP2D6CSNK1E | |
| Water SCHEMBL9250282 | 0.84 | CSNK1E (0.68) | TRPA1CYP2D6CSNK1E | |
| SCHEMBL18456337 | 0.84 | TRPA1 (1.00) | TRPA1CYP2D6CSNK1ESIGMAR1TAAR1 | |
| SCHEMBL12768230 | 0.84 | TRPA1 (1.00) | TRPA1CYP2D6CSNK1ESIGMAR1TAAR1 | |
| SCHEMBL3654793 | 0.84 | TRPA1 (0.55) | TRPA1CSNK1ESIGMAR1TAAR1SLC6A2 | |
| SCHEMBL7760979 | 0.83 | TRPA1 (0.65) | TRPA1CYP2D6CSNK1ESIGMAR1TAAR1 | |
| SCHEMBL16169480 | 0.80 | TRPA1 (0.71) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 | |
| SCHEMBL11590730 | 0.79 | CSNK1E (0.76) | TRPA1CYP2D6CSNK1ESIGMAR1TAAR1 | |
| SCHEMBL21852752 | 0.79 | TRPA1 (0.69) | TRPA1CYP2D6SIGMAR1TAAR1SLC6A2 |
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-20170354636-A1 | METHODS FOR INHIBITING TUMORS AND DRUG RESISTANCE | SEQUOIA PHARMACEUTICALS INC (US) | 2017-12-14 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20170354636-A1 | METHODS FOR INHIBITING TUMORS AND DRUG RESISTANCE | HCCS, CYP2E1, CYP7A1 | TRPA1 4850/4885CYP2D6 47/4885CSNK1E 1484/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.