Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6742211 | 0.74 | CYP1A2 (0.50) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL7774162 | 0.69 | CYP1A2 (0.49) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL6050883 | 0.68 | CYP1A2 (0.39) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL18546810 | 0.66 | HSD17B10 (0.57) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL17083456 | 0.64 | CYP1A2 (0.45) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL55779 | 0.63 | HSD17B10 (0.50) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL17083465 | 0.62 | CYP1A2 (0.42) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL27865920 | 0.62 | CYP1A2 (0.48) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL17083457 | 0.61 | CYP1A2 (0.41) | ERBB2CYP1A2FYNMAOAACHE | |
| SCHEMBL17691982 | 0.59 | ALDH1A1 (0.44) | ERBB2CYP1A2FYNMAOAACHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1636232-A2 | IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES | 4 AZA Bioscience nv (BE) | 2006-03-22 | — | — | EP | disclosed |
| WO-2004104005-A2 | IMMUNOSUPPRESSIVE EFFECTS OF PTERIDINE DERIVATIVES | 4 AZA BIOSCIENCE NV (BE) | 2004-12-02 | — | — | WO | disclosed |