Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 5/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11622662 | 0.81 | APP (0.44) | GRM2HTR2AAKR1C3AKR1C2CYP2C9 | |
| SCHEMBL11544303 | 0.81 | LMNA (0.43) | AKR1C3AKR1C2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11542157 | 0.81 | AKR1C3 (0.40) | GRM2HTR2AAKR1C3AKR1C2CYP2C9 | |
| SCHEMBL11445581 | 0.80 | GRIA4 (0.50) | GRM2AKR1C3AKR1C2MEN1PTGS1 | |
| SCHEMBL7360258 | 0.78 | AOC3 (0.38) | LMNATSHRALDH1A1 | |
| SCHEMBL12418419 | 0.78 | APP (0.46) | AKR1C3AKR1C2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11540642 | 0.77 | CYP2C19 (0.41) | GRM2HTR2AAKR1C3AKR1C2CYP2C9 | |
| SCHEMBL10781702 | 0.76 | PTGS2 (0.45) | AKR1C3AKR1C2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11543436 | 0.75 | CYP2C19 (0.46) | AKR1C3AKR1C2CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL11545047 | 0.75 | CYP2C19 (0.44) | AKR1C3AKR1C2CYP2C9CYP2C19CYP3A4 |
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-4151302-A | Araliphatic dihalogen compounds composition and method of use | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1979-04-24 | — | — | US | disclosed |
| US-4057647-A | Araliphatic dihalogen compounds and process for their preparation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) | 1977-11-08 | — | — | US | disclosed |