Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | WRN | Q14191 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10948755 | 0.85 | NPC1 (0.44) | CYP2C9CYP2C19CYP1A2RAB9ANPC1 | |
| SCHEMBL10951881 | 0.76 | KMT2A (0.40) | CYP2C9CYP2C19CYP1A2ALDH1A1MEN1 | |
| SCHEMBL10736082 | 0.75 | OPRM1 (0.35) | ALDH1A1MAPTMEN1KMT2ALMNA | |
| SCHEMBL10942813 | 0.75 | KMT2A (0.40) | CYP2C9CYP2C19CYP1A2ALDH1A1MEN1 | |
| SCHEMBL10951017 | 0.74 | ALDH1A1 (0.37) | CYP2C9CYP2C19CYP1A2RAB9ANPC1 | |
| SCHEMBL10948061 | 0.72 | KMT2A (0.45) | CYP2C9CYP2C19RAB9ANPC1ALDH1A1 | |
| SCHEMBL10946106 | 0.70 | PGR (0.42) | MAPTMEN1KMT2AHPGDSRC | |
| SCHEMBL10949107 | 0.69 | KMT2A (0.39) | ELANEALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL14506986 | 0.68 | RARA (0.46) | CYP2C9CYP2C19CYP1A2RAB9ANPC1 | |
| SCHEMBL10950452 | 0.67 | WRN (0.39) | CYP2C9CYP2C19CYP1A2RAB9ANPC1 |
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-4526723-A | Microbiocides | UNION CARBIDE CORPORATION (US) | 1985-07-02 | — | — | US | disclosed |