Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KCNQ3 | O43525 | 4/20 | 0.40 |
| ▸ | KCNQ2 | O43526 | 4/20 | 0.40 |
| ▸ | KCNQ4 | P56696 | 3/20 | 0.40 |
| ▸ | KCNQ5 | Q9NR82 | 3/20 | 0.40 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7557601 | 0.88 | ALDH1A1 (0.42) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL5397703 | 0.85 | ALDH1A1 (0.42) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL7664551 | 0.85 | ALDH1A1 (0.45) | ALDH1A1NLRP3KMT2ACYP1A2CYP2C9 | |
| SCHEMBL7562049 | 0.83 | KCNQ3 (0.45) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL7662875 | 0.77 | KCNQ3 (0.42) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL7557293 | 0.77 | ALDH1A1 (0.48) | ALDH1A1NLRP3KMT2ACYP1A2CYP2C9 | |
| SCHEMBL4278246 | 0.75 | ALDH1A1 (0.41) | ALDH1A1KCNQ3KCNQ2KMT2ACYP1A2 | |
| SCHEMBL7558526 | 0.73 | NLRP3 (0.54) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL7554735 | 0.73 | NLRP3 (0.45) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL13327532 | 0.72 | ALDH1A1 (0.41) | ALDH1A1KCNQ3KCNQ2KCNQ4KCNQ5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002056681-A2 | NOVEL INTERMEDIATES AND PROCESS TO PYRIMIDINEDIONE HERBICIDES | FMC CORPORATION (US) | 2002-07-25 | — | — | WO | disclosed |