Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15823628 | 0.87 | CYP3A4 (0.41) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL14645811 | 0.87 | CYP3A4 (0.41) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL15821872 | 0.87 | CYP3A4 (0.41) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL17223583 | 0.86 | ALDH1A1 (0.43) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL15823160 | 0.86 | ALDH1A1 (0.43) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL9835349 | 0.86 | ALDH1A1 (0.43) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL9834796 | 0.85 | ALDH1A1 (0.42) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL20337062 | 0.84 | CYP3A4 (0.39) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL15757192 | 0.84 | ALDH1A1 (0.42) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 | |
| SCHEMBL20337002 | 0.83 | CYP3A4 (0.43) | CYP3A4ALDH1A1KMT2ACYP19A1CYP2C9 |
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-20180184654-A1 | Pesticidal Compositions Comprising a Triazole Compound | BASF SE (DE) | 2018-07-05 | — | — | 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-20180184654-A1 | Pesticidal Compositions Comprising a Triazole Compound | ITPR3, ITPR2, CYP51A1 | CYP3A4 404/4885ALDH1A1 2461/4885KMT2A 1916/4885 |
“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.