Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAT2A | P31153 | 2/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9062118 | 1.00 | IDO1 (0.43) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL10337704 | 0.97 | IDO1 (0.41) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL8380863 | 0.96 | IDO1 (0.42) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL8380865 | 0.96 | IDO1 (0.42) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL9064219 | 0.96 | IDO1 (0.45) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL9064222 | 0.96 | IDO1 (0.45) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL9060779 | 0.95 | IDO1 (0.41) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL9061485 | 0.95 | IDO1 (0.41) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL9060775 | 0.95 | IDO1 (0.41) | IDO1CYP2C9MAPTMEN1MAPK1 | |
| SCHEMBL9060132 | 0.95 | IDO1 (0.41) | IDO1CYP2C9MAPTMEN1MAPK1 |
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 3 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 |