Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 2/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16836085 | 0.85 | TYR (0.46) | TYRCYP3A4ALDH1A1MEN1MAPT | |
| SCHEMBL4443109 | 0.82 | CYP3A4 (0.56) | TYRBCHEACHECYP3A4HPGD | |
| SCHEMBL8153518 | 0.80 | MAOB (0.44) | TYRBCHEACHECYP3A4MEN1 | |
| SCHEMBL11558507 | 0.79 | HPGD (0.50) | TYRBCHEACHECYP3A4HPGD | |
| SCHEMBL16685610 | 0.78 | TUBB4A (0.43) | TYRBCHEACHECYP3A4ALDH1A1 | |
| SCHEMBL4656144 | 0.78 | BCHE (0.54) | TYRBCHEACHECYP3A4NPC1 | |
| SCHEMBL9391336 | 0.76 | CES2 (0.50) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL4731187 | 0.76 | TYR (0.49) | TYRBCHEACHECYP3A4HPGD | |
| SCHEMBL5144377 | 0.75 | ESR1 (0.55) | TYRBCHEACHECYP3A4HPGD | |
| SCHEMBL788027 | 0.75 | LMNA (0.44) | CYP3A4HPGDALDH1A1MAPK1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1281598-C | Compounds and methods for modulation of estrogen receptors | SIGNAL PHARM INC (US) | 2006-10-25 | — | — | CN | disclosed |
| CN-1437591-A | Compounds and methods for modulation of estrogen receptors | SIGNAL PHARM INC (US) | 2003-08-20 | — | — | CN | disclosed |