Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | HRH1 | P35367 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | GHSR | Q92847 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | CACNA1A | O00555 | 1/20 | 0.43 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.43 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5098887 | 0.89 | CYP2D6 (0.50) | CYP2D6KCNH2LMNANR1I2ADORA3 | |
| SCHEMBL3541460 | 0.82 | SLC6A5 (0.44) | KCNH2CACNA1GDRD2 | |
| SCHEMBL7467030 | 0.79 | DNMT1 (0.53) | KCNH2HRH1DRD2 | |
| SCHEMBL5814284 | 0.79 | CARM1 (0.50) | HRH3DRD2 | |
| SCHEMBL11184948 | 0.76 | AHR (0.51) | LMNAKMT2ADRD2LTA4HPTGS2 | |
| SCHEMBL5113084 | 0.75 | LTA4H (0.53) | HRH3KMT2AMEN1LTA4HPTGS2 | |
| SCHEMBL5009325 | 0.75 | DRD2 (0.46) | KCNH2HRH3CACNA1GDRD2 | |
| SCHEMBL5814289 | 0.74 | OPRM1 (0.47) | KCNH2DRD2 | |
| SCHEMBL5788585 | 0.74 | MEN1 (0.45) | KCNH2LMNAHRH3CACNA1GKMT2A | |
| SCHEMBL5787380 | 0.73 | CYP2D6 (0.39) | CYP2D6LMNAHRH3CACNA1GKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-H2007-H1 | INSECTICIDES | FMC CORPORATION | 2001-12-04 | — | — | US | disclosed |
| WO-1997026252-A1 | INSECTICIDAL N-HETEROCYCLYLALKYL- OR N-[(POLYCYCLYL)-ALKYL]-N'-SUBSTITUTED PIPERAZINES | FMC CORPORATION (US) | 1997-07-24 | — | — | WO | disclosed |