Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.45 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.42 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5861445 | 0.85 | CASP1 (0.59) | ALDH1A1CASP1KMT2A | |
| SCHEMBL31506886 | 0.83 | CASP1 (0.56) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL3685278 | 0.83 | CASP1 (0.56) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL29572218 | 0.83 | CASP1 (0.56) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL31612955 | 0.83 | CXCL8 (0.46) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL13403891 | 0.83 | CXCL8 (0.46) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL3697021 | 0.83 | CASP1 (0.45) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL22939 | 0.83 | CASP1 (0.56) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL29572016 | 0.83 | CASP1 (0.56) | ALDH1A1CASP1KMT2AABCB11THRB | |
| SCHEMBL253615 | 0.83 | CASP1 (0.56) | ALDH1A1CASP1KMT2AABCB11THRB |
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-20050222173-A1 | Triazolopyrimidines | BAYER CROPSCIENCE AG (DE) | 2005-10-06 | — | — | 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-20050222173-A1 | Triazolopyrimidines | Q6ZSR9, FLT3, PADI1 | ALDH1A1 398/4885CASP1 2901/4885KMT2A 981/4885 |
“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.