Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | APP | P05067 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPRG | P23470 | 1/20 | 0.36 |
| ▸ | ACP1 | P24666 | 1/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.36 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24538167 | 0.86 | KCNH2 (0.45) | CYP1A1CYP1A2CYP1B1KCNH2APP | |
| SCHEMBL7607569 | 0.85 | KCNH2 (0.50) | CYP1A1CYP1A2CYP1B1KCNH2APP | |
| SCHEMBL15077190 | 0.84 | GRM5 (0.39) | CYP1A1CYP1A2CYP1B1KCNH2MEN1 | |
| SCHEMBL15014376 | 0.83 | CYP1A2 (0.46) | CYP1A1CYP1A2CYP1B1KCNH2MEN1 | |
| SCHEMBL15014205 | 0.81 | CYP1A2 (0.43) | CYP1A1CYP1A2CYP1B1KCNH2APP | |
| SCHEMBL20006663 | 0.77 | MEN1 (0.42) | CYP1A1CYP1A2CYP1B1KCNH2APP | |
| SCHEMBL5886608 | 0.75 | APP (0.71) | CYP1A1CYP1A2CYP1B1KCNH2APP | |
| SCHEMBL91864 | 0.74 | GRM5 (0.40) | CYP1A1CYP1A2CYP1B1KCNH2MEN1 | |
| SCHEMBL21387115 | 0.74 | KCNH2 (0.47) | CYP1A1CYP1A2CYP1B1KCNH2APP | |
| SCHEMBL23956066 | 0.74 | KCNH2 (0.44) | CYP1A1CYP1A2CYP1B1KCNH2APP |
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-9605204-B2 | Liquid crystal medium and high frequency components comprising same | MERCK PATENT GMBH (DE) | 2017-03-28 | — | — | US | disclosed |