Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.50 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | F3 | P13726 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14223874 | 1.00 | CYP1A2 (0.50) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL9047452 | 1.00 | CYP1A2 (0.50) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL3438389 | 0.90 | ALDH1A1 (0.50) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL3438388 | 0.90 | ALDH1A1 (0.50) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL28845442 | 0.79 | CYP1A2 (0.46) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL27915218 | 0.78 | CYP1A2 (0.43) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL3438440 | 0.76 | ALDH1A1 (0.46) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL3438441 | 0.76 | ALDH1A1 (0.46) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL9047403 | 0.75 | MAPT (0.61) | CYP1A2MAPTCYP2D6CYP2C19LMNA | |
| SCHEMBL9048357 | 0.75 | MAPT (0.61) | CYP1A2MAPTCYP2D6CYP2C19LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0378953-B1 | Benzylidene azolyl methyl cycloalkane and its use as a fungicide | RHONE POULENC AGROCHIMIE (FR) | 1996-06-05 | — | — | EP | claimed |
| EP-0378953-B1 | Benzylidene azolyl methyl cycloalkane and its use as a fungicide | RHONE POULENC AGROCHIMIE (FR) | 1996-06-05 | — | — | EP | disclosed |