Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL9510189 | 0.99 | KDM1A (0.38) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL9508932 | 0.99 | KDM1A (0.38) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL9509020 | 0.99 | KDM1A (0.38) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL9510190 | 0.96 | KDM1A (0.40) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL5343315 | 0.92 | KDM1A (0.44) | KDM1ARCOR1CYP2C9MEN1KMT2A | |
| SCHEMBL9060795 | 0.92 | KDM1A (0.44) | KDM1ARCOR1CYP2C9MEN1KMT2A | |
| SCHEMBL8375654 | 0.91 | CYP2C9 (0.46) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL3161974 | 0.91 | CYP2C9 (0.34) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL3161967 | 0.91 | CYP2C9 (0.34) | KDM1ARCOR1CYP2C9ACACBMEN1 | |
| SCHEMBL9061228 | 0.91 | KDM1A (0.43) | KDM1ARCOR1CYP2C9MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308438-B1 | LIQUID CRYSTAL PHASE CONTAINING TOLANES | MERCK PATENT GmbH (DE) | 1993-09-29 | — | — | EP | claimed |