Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 3/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.36 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | BLM | P54132 | 2/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.36 |
| ▸ | ALB | P02768 | 1/20 | 0.36 |
| ▸ | RARB | P10826 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13963069 | 0.83 | GABRA1 (0.46) | GABRA1GABRB2CHRM1PDE4APTGS2 | |
| SCHEMBL20934617 | 0.82 | HPGD (0.35) | CHRM1PTGS2LMNACYP2C9ESR1 | |
| SCHEMBL7562470 | 0.80 | GABRA1 (0.50) | GABRA1GABRB2CHRM1PTGS2PTGS1 | |
| SCHEMBL2730152 | 0.78 | HPGD (0.41) | TSHRHPGDMEN1KMT2AMAPT | |
| SCHEMBL17704659 | 0.78 | ESR1 (0.48) | ESR1TSHRHPGDMEN1KMT2A | |
| SCHEMBL10159746 | 0.78 | GABRA1 (0.63) | GABRA1GABRB2CHRM1PTGS2LMNA | |
| SCHEMBL5018733 | 0.78 | GABRA1 (0.44) | GABRA1GABRB2CHRM1PDE4APTGS2 | |
| SCHEMBL2416692 | 0.78 | GABRA1 (0.44) | GABRA1GABRB2CHRM1PDE4APTGS2 | |
| SCHEMBL10257025 | 0.76 | HPGD (0.43) | PTGS2PTGS1LMNAALOX5HPGD | |
| SCHEMBL1774615 | 0.76 | HPGD (0.39) | LMNACYP2C9ESR1TSHRHPGD |
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-101384531-A | Liquid-crystalline styryl derivative, process for producing the same, and liquid-crystalline semiconductor element employing the same | UNIV YAMANASHI (JP) | 2009-03-11 | — | — | CN | disclosed |
| CN-1241176-A | Prevention of loss and restoration of bone mass by certain prostaglandin agonists | PFIZER (US) | 2000-01-12 | — | — | CN | disclosed |