Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SPHK1 | Q9NYA1 | 5/20 | 0.34 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | FPR2 | P25090 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.32 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2604706 | 1.00 | CYP2C9 (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL19985354 | 0.99 | MAPT (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL22277505 | 0.99 | CYP2C9 (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL13263301 | 0.99 | CYP2C9 (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL19985348 | 0.99 | MAPT (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL19985334 | 0.99 | MAPT (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL2604711 | 0.96 | CYP2C9 (0.37) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL9406205 | 0.94 | CYP2C9 (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL9406200 | 0.94 | CYP2C9 (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA | |
| SCHEMBL19985336 | 0.94 | CYP2C9 (0.36) | CYP2C9ESR2MAPTALDH1A1LMNA |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0513262-B1 | 3,6-DISUBSTITUTED 2-FLUOROPYRIDINES | MERCK PATENT GMBH (DE) | 2000-04-05 | — | — | EP | disclosed |
| US-5980778-A | STABILITY, COMPATIBILITY | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1999-11-09 | — | — | US | disclosed |
| EP-0768361-A1 | Liquid crystal composition and liquid crystal display element comprising the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1997-04-16 | — | — | EP | disclosed |
| US-5389291-A | Components of liquid crystalline media | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1995-02-14 | — | — | US | disclosed |
| US-5279764-A | Dihalogenobenzene derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-01-18 | — | — | US | disclosed |
| EP-0513262-A1 | 3,6-DISUBSTITUTED 2-HALOPYRIDINES | MERCK PATENT GmbH (DE) | 1992-11-19 | — | — | EP | disclosed |
| WO-1992009576-A1 | 3,6-DISUBSTITUTED 2-HALOPYRIDINES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1992-06-11 | — | — | WO | disclosed |