Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 2/20 | 0.42 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 2/20 | 0.33 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8024950 | 1.00 | ESR2 (0.42) | ESR2PGRNPC1RAB9AP2RY14 | |
| SCHEMBL8379902 | 0.91 | ESR2 (0.51) | ESR2PGRNPC1RAB9AP2RY14 | |
| SCHEMBL7775189 | 0.88 | ESR2 (0.43) | ESR2KDM1APDE4APDE4BPDE4C | |
| SCHEMBL7775191 | 0.88 | ESR2 (0.43) | ESR2KDM1APDE4APDE4BPDE4C | |
| SCHEMBL8768421 | 0.84 | PGR (0.39) | PGRNPC1RAB9AP2RY14CYP17A1 | |
| SCHEMBL8768418 | 0.84 | PGR (0.39) | PGRNPC1RAB9AP2RY14CYP17A1 | |
| SCHEMBL19850903 | 0.83 | KMT2A (0.39) | PGRNPC1RAB9AP2RY14CYP17A1 | |
| SCHEMBL13345629 | 0.82 | KDM1A (0.35) | PGRNPC1RAB9AP2RY14CYP17A1 | |
| SCHEMBL14064159 | 0.82 | ESR2 (0.46) | ESR2PGRNPC1RAB9AP2RY14 | |
| SCHEMBL8015335 | 0.81 | P2RY14 (0.33) | PGRNPC1RAB9AP2RY14CYP17A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0497176-B1 | Four rings compounds and liquid crystal mixtures containing them | MERCK PATENT GMBH (DE) | 2000-04-05 | — | — | EP | disclosed |
| US-5478497-A | For electro-optical purposes | HOFFMANN-LA ROCHE INC. (US) | 1995-12-26 | — | — | US | disclosed |
| EP-0497176-A2 | Four rings compounds and liquid crystal mixtures containing them | F. HOFFMANN-LA ROCHE AG (CH) | 1992-08-05 | — | — | EP | disclosed |