Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | F2R | P25116 | 9/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11862973 | 0.92 | F2R (0.56) | CYP1A2CYP3A4CYP2C19F2RALDH1A1 | |
| SCHEMBL11875093 | 0.88 | F2R (0.57) | CYP1A2CYP3A4CYP2C19F2RALDH1A1 | |
| SCHEMBL11877061 | 0.83 | F2R (0.58) | CYP1A2CYP3A4CYP2C19F2RALDH1A1 | |
| SCHEMBL10975643 | 0.81 | F2R (0.73) | F2RALDH1A1 | |
| SCHEMBL10969527 | 0.78 | KDM4E (0.72) | CYP1A2CYP3A4CYP2C19F2RALDH1A1 | |
| SCHEMBL28513540 | 0.77 | ALDH1A1 (0.64) | CYP1A2CYP3A4CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL11901010 | 0.77 | LMNA (0.69) | CYP1A2CYP3A4CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL11756097 | 0.77 | POLB (0.72) | CYP1A2CYP3A4CYP2C19F2RALDH1A1 | |
| SCHEMBL11873376 | 0.77 | LMNA (0.53) | F2RALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL31122194 | 0.74 | ALDH1A1 (0.59) | CYP3A4ALDH1A1SMN1; SMN2KMT2ANPSR1 |
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-3979202-A | Meta-bifunctional benzenes and herbicidal compositions | MONSANTO COMPANY (US) | 1976-09-07 | — | — | US | disclosed |