Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 3/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 3/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27630319 | 0.77 | CYP2D6 (0.43) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL8816057 | 0.75 | GRIN1 (0.47) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL4399833 | 0.74 | TAAR1 (0.50) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL113841 | 0.74 | TAAR1 (0.50) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL4399836 | 0.74 | TAAR1 (0.50) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL10952717 | 0.74 | CYP2C19 (0.44) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL27678661 | 0.73 | KCNN4 (0.46) | CYP1A2CYP2D6KCNN4TSHRTAAR1 | |
| SCHEMBL15228184 | 0.73 | TSHR (0.46) | CYP1A2CYP2D6KCNN4TSHRCYP2C9 | |
| Ammonia Solution, Strong SCHEMBL27739613 | 0.72 | TAAR1 (0.48) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D | |
| SCHEMBL28756807 | 0.72 | CYP2D6 (0.39) | CYP1A2CYP2D6GRIN1GRIN2AGRIN2D |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1318990-A1 | PROCESS FOR PREPARING OPTICALLY ACTIVE EPOXIDES | Phoenix Chemicals Limited (GB) | 2003-06-18 | — | — | EP | disclosed |
| WO-2002024671-A1 | PROCESS FOR PREPARING OPTICALLY ACTIVE EPOXIDES | PHOENIX CHEMICALS LIMITED (GB) | 2002-03-28 | — | — | WO | disclosed |
| EP-0804428-A1 | BIS-SULFONAMIDE HYDROXYETHYLAMINO RETROVIRAL PROTEASE INHIBITORS | G.D. SEARLE & CO. (US) | 1997-11-05 | — | — | EP | disclosed |
| EP-0656888-A1 | SULFONYLALKANOYLAMINO HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS | G.D. SEARLE & CO. (US) | 1995-06-14 | — | — | EP | disclosed |