Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7779517 | 0.93 | NQO1 (0.42) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL7780453 | 0.93 | NQO1 (0.42) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL7782180 | 0.83 | NQO1 (0.39) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL7782402 | 0.83 | NQO1 (0.41) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL4800850 | 0.82 | CYP2C9 (0.55) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL1894069 | 0.82 | CYP2C9 (0.55) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL7782065 | 0.82 | NQO1 (0.40) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL7782164 | 0.82 | CYP2C9 (0.46) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL17616203 | 0.78 | CYP2C9 (0.51) | NQO1CYP2C9RAB9ANPC1CASP3 | |
| SCHEMBL10761184 | 0.78 | CYP2C9 (0.51) | NQO1CYP2C9RAB9ANPC1CASP3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0637623-B1 | Cyclic hydrocarbon derivative and liquid crystal composition containing the same | DAINIPPON INK & CHEMICALS (JP) | 2001-10-04 | — | — | EP | disclosed |
| EP-0637623-A1 | Cyclic hydrocarbon derivative and liquid crystal composition containing the same | DAINIPPON INK AND CHEMICALS, INC. (JP) | 1995-02-08 | — | — | EP | disclosed |