Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL266904 | 0.90 | ALDH1A1 (0.48) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL6356850 | 0.89 | AKR1C2 (0.58) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| Hydrochloric Acid SCHEMBL6347252 | 0.88 | AKR1C2 (0.57) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL6919361 | 0.82 | HSD17B10 (0.44) | ALDH1A1HSD17B10HTTCYP1A2CYP3A4 | |
| SCHEMBL6350712 | 0.81 | AKR1C2 (0.63) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL266720 | 0.78 | ALDH1A1 (0.48) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL6350766 | 0.77 | ALDH1A1 (0.46) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL266398 | 0.76 | AKR1C2 (0.54) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL31454340 | 0.75 | MAPT (0.72) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 | |
| SCHEMBL14075415 | 0.75 | MAPT (0.72) | ALDH1A1AKR1C2AKR1C1AKR1C4AKR1C3 |
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-20050113450-A1 | Antibacterial agents | PHARMACIA & UPJOHN COMPANY | 2005-05-26 | — | — | 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-20050113450-A1 | Antibacterial agents | CLPP, SPOUT1, SAMHD1 | ALDH1A1 462/4885AKR1C2 3012/4885AKR1C1 2615/4885 |
“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.