Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | IDH2 | P48735 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11532322 | 0.86 | CYP19A1 (0.63) | CYP19A1LMNAMAPTHSP90AA1TSHR | |
| SCHEMBL11539986 | 0.83 | KDM4E (0.39) | CYP19A1KDM4EALOX15LMNAALDH1A1 | |
| SCHEMBL21738 | 0.82 | KDM4E (0.41) | CYP19A1KDM4EALOX15ALDH1A1HPGD | |
| SCHEMBL11533125 | 0.81 | CYP19A1 (0.57) | CYP19A1LMNAHSP90AA1CYP3A4 | |
| SCHEMBL11533166 | 0.79 | CYP19A1 (0.59) | CYP19A1KDM4ELMNAALDH1A1HPGD | |
| SCHEMBL11534215 | 0.78 | LMNA (0.40) | CYP19A1KDM4EALOX15LMNAALDH1A1 | |
| SCHEMBL11533466 | 0.78 | MAPT (0.40) | KDM4EALOX15LMNAALDH1A1HPGD | |
| SCHEMBL11536102 | 0.78 | CYP19A1 (0.42) | CYP19A1KDM4EALOX15LMNAALDH1A1 | |
| SCHEMBL11531998 | 0.77 | CES2 (0.42) | LMNAALDH1A1HPGDMAPTSMN1; SMN2 | |
| SCHEMBL11535619 | 0.75 | CYP19A1 (0.55) | CYP19A1KDM4ELMNAALDH1A1HPGD |
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 |