Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.41 |
| ▸ | MMP3 | P08254 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL11047122 | 1.00 | CYP2C9 (0.52) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL9561925 | 0.95 | CYP2C9 (0.56) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL9841403 | 0.95 | CYP2C9 (0.56) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL2911946 | 0.94 | CYP2C9 (0.55) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10910889 | 0.90 | CYP2C9 (0.54) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8527560 | 0.90 | CYP2C9 (0.54) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8527556 | 0.90 | CYP2C9 (0.54) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL8527562 | 0.90 | CYP2C9 (0.54) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10895608 | 0.90 | NPC1 (0.44) | CYP2C9ALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL10895614 | 0.90 | NPC1 (0.44) | CYP2C9ALDH1A1LMNAMAPTMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4439340-A | LIQUID CRYSTALS | CHISSO CORPORATION (JP) | 1984-03-27 | — | — | US | disclosed |