Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.41 |
| ▸ | KIF11 | P52732 | 5/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL11532598 | 0.93 | CYP19A1 (0.43) | CYP19A1KIF11CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11531310 | 0.90 | CYP19A1 (0.49) | CYP19A1KIF11CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11536380 | 0.87 | CYP19A1 (0.54) | CYP19A1KIF11CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11534213 | 0.84 | CYP19A1 (0.47) | CYP19A1CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11533590 | 0.81 | CYP19A1 (0.51) | CYP19A1CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11536102 | 0.79 | CYP19A1 (0.42) | CYP19A1KIF11CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11535493 | 0.78 | CYP19A1 (0.41) | CYP19A1KIF11CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11530600 | 0.76 | LMNA (0.35) | CYP19A1KIF11CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL11530495 | 0.76 | CYP19A1 (0.49) | CYP19A1CYP2C9CYP2C19CYP3A4KCNH2 | |
| SCHEMBL11532244 | 0.75 | CYP19A1 (0.66) | CYP19A1CYP3A4HSP90AA1LMNA |
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-4140782-A | Combating fungi and nematodes with diphenyl-triazolyl-methanes | BAYER AKTIENGESELLSCHAFT (DE) | 1979-02-20 | — | — | US | disclosed |