Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 4/20 | 0.38 |
| ▸ | CASP3 | P42574 | 9/20 | 0.37 |
| ▸ | CASP7 | P55210 | 8/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 2/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD5 | P21918 | 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 | |
|---|---|---|---|---|
| SCHEMBL11596274 | 0.88 | CASP3 (0.38) | CYP1A1CASP3CASP7CASP1LMNA | |
| SCHEMBL11596316 | 0.80 | CYP1A1 (0.36) | CYP1A1LMNAMAPTGAAPOLB | |
| SCHEMBL11596272 | 0.73 | ALDH1A1 (0.52) | LMNAHTTALDH1A1MAPTGAA | |
| SCHEMBL11745182 | 0.71 | GAA (0.51) | CASP3CASP1ALDH1A1MAPTGAA | |
| SCHEMBL11596313 | 0.69 | NR1I2 (0.39) | CYP1A1HTTMAPTGAAPOLB | |
| SCHEMBL11596639 | 0.67 | ALDH1A1 (0.38) | LMNAALDH1A1MAPTGAAPOLB | |
| SCHEMBL11596438 | 0.66 | DRD2 (0.36) | CASP1LMNAALDH1A1MAPTGAA | |
| SCHEMBL11596409 | 0.66 | ALDH1A1 (0.38) | LMNAALDH1A1MAPTGAAPOLB | |
| SCHEMBL11653503 | 0.66 | CASP6 (0.53) | CASP3CASP1HTTALDH1A1MAPT | |
| SCHEMBL5451996 | 0.65 | NPC1 (0.55) | LMNAHTTALDH1A1MAPTGAA |
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-4078933-A | OXONOL DYE | FUJI PHOTO FILM CO., LTD. (JA) | 1978-03-14 | — | — | US | disclosed |