Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11578 | 1.00 | SLC6A2 (0.42) | SLC6A2SLC6A4SLC6A3CYP2A6CYP1A2 | |
| SCHEMBL2131604 | 1.00 | SLC6A2 (0.42) | SLC6A2SLC6A4SLC6A3CYP2A6CYP1A2 | |
| SCHEMBL4498309 | 0.93 | ALDH1A1 (0.41) | SLC6A2SLC6A4SLC6A3CYP2A6CYP1A2 | |
| SCHEMBL5011306 | 0.93 | ALDH1A1 (0.41) | SLC6A2SLC6A4SLC6A3CYP2A6CYP1A2 | |
| SCHEMBL11602636 | 0.84 | CYP2A6 (0.50) | SLC6A2SLC6A4SLC6A3CYP2A6CYP1A2 | |
| SCHEMBL28263800 | 0.79 | CYP2A6 (0.44) | SLC6A2SLC6A4SLC6A3CYP2A6CYP1A2 | |
| SCHEMBL23232284 | 0.77 | IDO1 (0.41) | CYP19A1 | |
| SCHEMBL7073627 | 0.77 | ESR1 (0.48) | SLC6A2SLC6A4SLC6A3CYP1A2ALOX15 | |
| SCHEMBL17014700 | 0.75 | TYR (0.41) | ALOX15HTR2ACYP2C19TSHR | |
| SCHEMBL9732281 | 0.75 | CHRNA7 (0.46) | ALOX5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7407959-B2 | Cathepsin cysteine protease inhibitors | MERCK FROSST CANADA & CO. (CA) | 2008-08-05 | — | — | US | disclosed |
| US-20070293578-A1 | Cathepsin Cysteine Protease Inhibitors | GAUTHIER JACQUES Y | 2007-12-20 | — | — | US | disclosed |
| US-20060111440-A1 | Cathepsin cysteine protease inhibitors | MERCK CANADA INC. (CA) | 2006-05-25 | — | — | 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-20060111440-A1 | Cathepsin cysteine protease inhibitors | CTSB, CTSS, CTSZ | SLC6A2 4308/4885SLC6A4 4386/4885SLC6A3 4059/4885 |
| US-20070293578-A1 | Cathepsin Cysteine Protease Inhibitors | CTSB, CTSS, CTSE | SLC6A2 4322/4885SLC6A4 4027/4885SLC6A3 2918/4885 |
“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.