Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.45 |
| ▸ | CHRNA5 | P30532 | 2/20 | 0.45 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 5/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL513742 | 0.71 | ALDH1A1 (0.50) | CYP2A6ALDH1A1CYP3A4CYP1A2CHRNB2 | |
| SCHEMBL30473120 | 0.67 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| SCHEMBL120088 | 0.67 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| SCHEMBL29419014 | 0.67 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| SCHEMBL9983003 | 0.67 | CYP2A6 (0.48) | CYP2A6ALDH1A1CYP3A4CYP1A2CHRNB2 | |
| Phosphine SCHEMBL28126457 | 0.65 | CYP2A6 (0.94) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| Hydrochloric Acid SCHEMBL4831090 | 0.65 | CYP2A6 (0.94) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| SCHEMBL27812368 | 0.65 | CYP2A6 (0.94) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| SCHEMBL28301145 | 0.65 | CYP2A6 (0.94) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 | |
| SCHEMBL28275760 | 0.65 | CYP2A6 (0.94) | CYP2A6ALDH1A1CYP3A4CYP1A2TP53 |
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-20110319400-A1 | PROKINETICIN 1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PAIN | JANSSEN PHARMACEUTICA, NV (BE) | 2011-12-29 | — | — | 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-20110319400-A1 | PROKINETICIN 1 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF PAIN | PROKR1, OPRL1, PROKR2 | CYP2A6 3711/4885ALDH1A1 1573/4885CYP3A4 4099/4885 |
“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.