Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.36 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.36 |
| ▸ | UGT1A4 | P22310 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL19347156 | 0.89 | CYP1A2 (0.35) | CYP19A1EGLN3ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL19347170 | 0.87 | CYP1A2 (0.34) | CYP19A1EGLN3ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL9635308 | 0.85 | KCNH2 (0.36) | CYP19A1EGLN3CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19347165 | 0.85 | KCNH2 (0.36) | CYP19A1EGLN3CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19347160 | 0.85 | KCNH2 (0.36) | CYP19A1EGLN3CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19347168 | 0.85 | KCNH2 (0.36) | CYP19A1EGLN3CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL19347154 | 0.85 | CYP19A1 (0.39) | CYP19A1EGLN3UGT1A4PDE4DALDH1A1 | |
| SCHEMBL8178858 | 0.83 | CYP19A1 (0.43) | CYP19A1EGLN3ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL10834083 | 0.82 | KCNH2 (0.36) | CYP19A1EGLN3CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL23876035 | 0.81 | EGLN3 (0.42) | CYP19A1EGLN3UGT1A4PDE4DALDH1A1 |
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-9765276-B2 | Additive for lubricant compositions comprising a sulfur-containing and a sulfur-free organomolybdenum compound, and a triazole or a derivatized triazole | VANDERBILT CHEMICALS, LLC (US) | 2017-09-19 | — | — | US | disclosed |