Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | OGG1 | O15527 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11277910 | 0.77 | L3MBTL1 (0.46) | HTTKMT2ATP53GAA | |
| SCHEMBL11099147 | 0.76 | CYP1A2 (0.57) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL8849551 | 0.76 | CYP1A2 (0.57) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL31561763 | 0.76 | CYP1A2 (0.57) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL9259535 | 0.74 | CYP1A2 (0.59) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL11053438 | 0.73 | CYP1A2 (0.54) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL7602618 | 0.71 | SRC (0.58) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL29093880 | 0.71 | CYP1A2 (0.56) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL11771178 | 0.70 | WDR5 (0.44) | CYP1A2CYP2C9CYP2C19CYP2D6HTT | |
| SCHEMBL8124927 | 0.70 | — | — |
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-4322414-A | MITICIDES; APHIDICIDES; LARVICIDES | VELSICOL CHEMICAL CORPORATION (US) | 1982-03-30 | — | — | US | disclosed |