Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | APAF1 | O14727 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | IL4I1 | Q96RQ9 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.43 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14732041 | 0.73 | NPSR1 (0.47) | NPSR1 | |
| SCHEMBL2432421 | 0.72 | KDM4E (0.43) | ALDH1A1KDM4ENPSR1TSHRHSD17B10 | |
| SCHEMBL2432424 | 0.72 | DAO (0.41) | ALDH1A1KDM4ENPSR1MAPK1TSHR | |
| SCHEMBL31184774 | 0.70 | FLT3 (0.42) | ALDH1A1KDM4EMAPK1HSD17B10LMNA | |
| SCHEMBL6402311 | 0.70 | DAO (0.59) | ALDH1A1KDM4ENPSR1MAPK1TSHR | |
| SCHEMBL17618004 | 0.70 | KDM4E (0.58) | ALDH1A1KDM4ENPSR1MAPK1TSHR | |
| SCHEMBL5473260 | 0.69 | KDM4E (0.58) | ALDH1A1KDM4ENPSR1MAPK1TSHR | |
| Bicarbonate SCHEMBL6993932 | 0.69 | MAPK1 (0.61) | ALDH1A1KDM4ENPSR1MAPK1TSHR | |
| SCHEMBL30434363 | 0.69 | MAPK1 (0.61) | ALDH1A1KDM4ENPSR1MAPK1TSHR | |
| SCHEMBL5678790 | 0.69 | MAPK1 (0.61) | ALDH1A1KDM4ENPSR1MAPK1TSHR |
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-20110212946-A1 | Quinolone Neuropeptide S Receptor Antagonists | MERCK SHARP & DOHME LLC | 2011-09-01 | — | — | 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-20110212946-A1 | Quinolone Neuropeptide S Receptor Antagonists | NPSR1, NPY1R, NPY2R | ALDH1A1 4731/4885KDM4E 4352/4885NPSR1 1/4885 |
“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.