Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 8/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.69 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.43 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.42 |
| ▸ | HK1 | P19367 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| Nicotyrine SCHEMBL2996756 | 0.82 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP2A13CYP2C9CYP2C19 | |
| Nicotyrine SCHEMBL29398389 | 0.82 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP2A13CYP2C9CYP2C19 | |
| SCHEMBL439225 | 0.82 | KDM4E (0.49) | CYP2A6ALDH1A1CYP2A13HSD17B10NPC1 | |
| SCHEMBL3194702 | 0.80 | CYP2A6 (0.74) | CYP2A6ALDH1A1CYP19A1CYP3A4CYP1A2 | |
| SCHEMBL12925581 | 0.75 | CYP2A6 (0.67) | CYP2A6ALDH1A1CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL18905222 | 0.75 | CYP19A1 (0.69) | CYP2A6ALDH1A1CYP19A1CYP3A4CYP1A2 | |
| Nicotyrine SCHEMBL6845683 | 0.74 | ALDH1A1 (0.65) | CYP2A6ALDH1A1CYP2A13CYP2C9CYP2C19 | |
| SCHEMBL14297284 | 0.73 | CYP2A6 (0.65) | CYP2A6ALDH1A1CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10031168 | 0.73 | CYP2A6 (0.65) | CYP2A6ALDH1A1CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL2460181 | 0.72 | PPARA (0.64) | CYP2A6ALDH1A1CYP2A13HSD17B10NPC1 |
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-11168103-B2 | Organic electroluminescent materials and devices | UNIVERSAL DISPLAY CORPORATION (US) | 2021-11-09 | — | — | US | disclosed |
| US-20190153009-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | UNIVERSAL DISPLAY CORPORATION | 2019-05-23 | — | — | 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 (2 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-20190153009-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | CHRM4, CHRM1, OPRD1 | CYP2A6 727/4885ALDH1A1 2688/4885CYP2A13 1516/4885 |
| US-11168103-B2 | Organic electroluminescent materials and devices | OCIAD1, OCIAD2, OR10J3 | CYP2A6 3287/4885ALDH1A1 716/4885CYP2A13 4276/4885 |
“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.