Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.52 |
| ▸ | MAOB | P27338 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | AR | P10275 | 7/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 3/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9746014 | 0.97 | CYP19A1 (0.52) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL9747122 | 0.91 | CYP19A1 (0.52) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL9747888 | 0.87 | MAOB (0.50) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL13908822 | 0.84 | CYP19A1 (0.65) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL6289952 | 0.83 | CYP19A1 (0.54) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL16310207 | 0.83 | CYP19A1 (0.54) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL6289949 | 0.83 | CYP19A1 (0.54) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL19280735 | 0.83 | CYP19A1 (0.54) | CYP19A1MAOBALDH1A1HPGDAR | |
| SCHEMBL9746022 | 0.82 | SMN1; SMN2 (0.46) | CYP19A1ALDH1A1AR | |
| SCHEMBL31168160 | 0.82 | CYP19A1 (0.67) | CYP19A1MAOBALDH1A1HPGDAR |
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 |
|---|---|---|---|---|---|---|---|
| US-5118431-A | Phthalonitriles and phthalocyanines as lubricity-enhancing additives | THE DOW CHEMICAL COMPANY (US) | 1992-06-02 | — | — | US | disclosed |
| US-5061388-A | Novel phthalonitriles and phthalocyanines as lubricity-enhancing additives | THE DOW CHEMICAL COMPANY (US) | 1991-10-29 | — | — | US | disclosed |