Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 7/20 | 0.35 |
| ▸ | MAOB | P27338 | 5/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 4/20 | 0.33 |
| ▸ | HTR2A | P28223 | 4/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20152928 | 0.91 | MAOA (0.43) | MAOAMAOBMEN1KMT2A | |
| SCHEMBL20152912 | 0.71 | HTR1A (0.39) | MAOAMAOBHTR1AHTR7DRD2 | |
| SCHEMBL21938179 | 0.63 | ACHE (0.46) | PTGS1PTGS2MEN1KMT2A | |
| SCHEMBL20153038 | 0.63 | HTR2A (0.36) | MAOAMAOBHTR7HTR2A | |
| SCHEMBL19067821 | 0.63 | ALOX15 (0.54) | PTGS1PTGS2ALOX5RXFP1MEN1 | |
| SCHEMBL21363228 | 0.63 | ALOX15 (0.48) | PTGS1PTGS2ALOX5RXFP1MEN1 | |
| SCHEMBL21261243 | 0.60 | AR (0.39) | — | |
| SCHEMBL21363124 | 0.60 | SELL (0.48) | PTGS1PTGS2GSK3BALOX5RXFP1 | |
| SCHEMBL29836013 | 0.60 | ESR2 (0.52) | MAOAMAOBPTGS1PTGS2ALOX5 | |
| SCHEMBL19765495 | 0.59 | CA1 (0.41) | MAOAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018086197-A1 | CATALYTIC ASYMMETRIC SYNTHESIS METHOD FOR CHIRAL SPINOL DERIVATE | 南方科技大学 | 2018-05-17 | — | — | WO | disclosed |