Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | SHBG | P04278 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9204160 | 0.80 | EPHX1 (0.36) | ALDH1A1EPHX1SHBGTP53 | |
| SCHEMBL12803213 | 0.79 | SHBG (0.41) | ALDH1A1EPHX1SHBGTP53 | |
| SCHEMBL20600342 | 0.79 | SHBG (0.41) | ALDH1A1EPHX1SHBGTP53 | |
| SCHEMBL9209301 | 0.78 | ALDH1A1 (0.32) | ALDH1A1EPHX1SHBGTP53 | |
| SCHEMBL20600160 | 0.77 | SHBG (0.48) | ALDH1A1EPHX1SHBGTP53 | |
| SCHEMBL892128 | 0.76 | SHBG (0.39) | ALDH1A1EPHX1SHBG | |
| SCHEMBL7093118 | 0.75 | SHBG (0.32) | ALDH1A1EPHX1SHBG | |
| SCHEMBL7854964 | 0.75 | CYP1A2 (0.41) | ALDH1A1EPHX1 | |
| SCHEMBL3632509 | 0.74 | SHBG (0.44) | ALDH1A1EPHX1SHBG | |
| SCHEMBL5710495 | 0.73 | SHBG (0.36) | EPHX1SHBG |
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-4492791-A | Process for the preparation of polyaminotriazines | CIBA-GEIGY CORPORATION (US) | 1985-01-08 | — | — | US | disclosed |