Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4801614 | 1.00 | CYP2C9 (0.51) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL8376526 | 0.96 | CYP2C9 (0.48) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL8095280 | 0.96 | CYP2C9 (0.48) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL8095275 | 0.96 | CYP2C9 (0.48) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL8376523 | 0.96 | CYP2C9 (0.48) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL10337587 | 0.96 | CYP2C9 (0.48) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL7513854 | 0.96 | CYP2C9 (0.48) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL9061116 | 0.93 | CYP2C9 (0.46) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL9061122 | 0.93 | CYP2C9 (0.46) | CYP2C9MEN1KMT2AALDH1A1MAPT | |
| SCHEMBL9061790 | 0.92 | CYP2C9 (0.45) | CYP2C9MEN1KMT2AALDH1A1MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5536442-A | ELECTROOPTICS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-07-16 | — | — | US | disclosed |
| US-5389292-A | Liquid crystalline media having positive dielctric anisotropy, chemical, heat and radiation resistance, used as electro-optical displaying | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1995-02-14 | — | — | US | disclosed |
| EP-0381728-B1 | DIFLUOROMETHYL COMPOUNDS | MERCK PATENT GMBH (DE) | 1993-12-08 | — | — | EP | disclosed |
| EP-0381728-A1 | DIFLUOROMETHYL COMPOUNDS. | MERCK PATENT GMBH (DE) | 1990-08-16 | — | — | EP | disclosed |
| WO-1990001056-A1 | DIFLUOROMETHYL COMPOUNDS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1990-02-08 | — | — | WO | disclosed |