Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | LTC4S | Q16873 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2609992 | 0.78 | GABRA1 (0.36) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 | |
| SCHEMBL15631171 | 0.77 | CYP1A2 (0.39) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 | |
| SCHEMBL13728469 | 0.74 | CYP2A6 (0.48) | ALDH1A1CYP1A2 | |
| SCHEMBL66681 | 0.70 | ALDH1A1 (0.60) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 | |
| SCHEMBL15828569 | 0.69 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL12034464 | 0.69 | MAPT (0.46) | ALDH1A1 | |
| SCHEMBL9614515 | 0.69 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 | |
| SCHEMBL9862021 | 0.69 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 | |
| SCHEMBL1199043 | 0.69 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 | |
| SCHEMBL1199042 | 0.69 | ALDH1A1 (0.58) | ALDH1A1CYP1A2CYP2C9CYP2C19GABRA1 |
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-20150099781-A1 | Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2015-04-09 | — | — | 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-20150099781-A1 | Compounds and Methods for Treating Mammalian Gastrointestinal Microbial Infections | IMPDH1, IMPDH2, IMPA1 | ALDH1A1 45/4885CYP1A2 183/4885CYP2C9 316/4885 |
“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.