Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | HPGD | P15428 | 3/20 | 0.61 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.61 |
| ▸ | MAOB | P27338 | 4/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | AR | P10275 | 4/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.47 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.47 |
| ▸ | FNTA | P49354 | 1/20 | 0.46 |
| ▸ | FNTB | P49356 | 1/20 | 0.46 |
| ▸ | PGGT1B | P53609 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9746946 | 1.00 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL5143806 | 1.00 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9745656 | 1.00 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9747762 | 0.96 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL523446 | 0.96 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9747026 | 0.96 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL13908822 | 0.96 | CYP19A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL9745473 | 0.96 | ALDH1A1 (0.65) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL31168160 | 0.94 | CYP19A1 (0.67) | ALDH1A1HPGDCYP19A1MAOBNPSR1 | |
| SCHEMBL5145150 | 0.94 | CYP19A1 (0.67) | ALDH1A1HPGDCYP19A1MAOBNPSR1 |
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 |