Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.77 |
| ▸ | GAA | P10253 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | RAB9A | P51151 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 3/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | GLA | P06280 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | CPB1 | P15086 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | CNR2 | P34972 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL4215585 | 0.87 | ALDH1A1 (0.79) | ALDH1A1GAANPC1RAB9ACYP3A4 | |
| SCHEMBL4208941 | 0.86 | ALDH1A1 (0.73) | ALDH1A1GAANPC1RAB9ACYP3A4 | |
| SCHEMBL4205558 | 0.81 | ALDH1A1 (0.72) | ALDH1A1GAAKMT2ALMNAPOLB | |
| SCHEMBL4206160 | 0.78 | ALDH1A1 (0.67) | ALDH1A1GAAKMT2ALMNAPOLB | |
| SCHEMBL6405743 | 0.77 | CYP3A4 (0.69) | ALDH1A1NPC1RAB9ACYP3A4CYP2C19 | |
| SCHEMBL4212033 | 0.77 | ALDH1A1 (0.70) | ALDH1A1GAANPC1RAB9ACYP3A4 | |
| SCHEMBL20515272 | 0.76 | TSHR (0.61) | ALDH1A1GAACYP3A4CYP2C19KMT2A | |
| SCHEMBL6410634 | 0.76 | CYP3A4 (0.61) | ALDH1A1NPC1RAB9ACYP3A4CYP2C19 | |
| SCHEMBL6247799 | 0.76 | KMT2A (1.00) | ALDH1A1GAANPC1RAB9ACYP3A4 | |
| SCHEMBL4201282 | 0.75 | KMT2A (0.72) | ALDH1A1GAAKMT2ALMNAPOLB |
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-20050288347-A1 | Certain triazole-based compounds, compositions, and uses thereof | AGRIUS GROUP, LLC. | 2005-12-29 | — | — | 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-20050288347-A1 | Certain triazole-based compounds, compositions, and uses thereof | ABCG2, ATP5ME, DNTT | ALDH1A1 720/4885GAA 85/4885NPC1 2070/4885 |
“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.