Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8094304 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8095554 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8093199 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8096237 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8087525 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8087377 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8096117 | 0.99 | CYP19A1 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8092447 | 0.97 | TP53 (0.32) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8093774 | 0.96 | CYP19A1 (0.31) | CYP19A1GRM2 | |
| SCHEMBL8085569 | 0.96 | CYP19A1 (0.31) | CYP19A1GRM2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |