Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.49 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | MLNR | O43193 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | PGR | P06401 | 1/20 | 0.49 |
| ▸ | CTSD | P07339 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | PGA5 | P0DJD9 | 1/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.49 |
| ▸ | CTSE | P14091 | 1/20 | 0.49 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | DRD1 | P21728 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.49 |
| ▸ | CCKAR | P32238 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14416437 | 0.85 | PPARG (0.47) | KITPTGS2PPARGMLNRNR1I2 | |
| SCHEMBL14416436 | 0.85 | MLNR (0.46) | KITPTGS2PPARGMLNRNR1I2 | |
| SCHEMBL7761716 | 0.83 | MAPT (0.53) | KITKMT2AMAPTTP53FFAR1 | |
| SCHEMBL17052984 | 0.81 | FFAR4 (0.61) | PPARGKMT2AMAPTPKMMEN1 | |
| SCHEMBL5597568 | 0.81 | KIT (0.53) | KITPTGS2PPARGMLNRNR1I2 | |
| SCHEMBL15232986 | 0.78 | ERAP1 (0.60) | PPARGKMT2AMAPTPKMMEN1 | |
| SCHEMBL8366960 | 0.77 | MAPT (0.52) | PTGS1KMT2AMAPTPKMMEN1 | |
| SCHEMBL14420639 | 0.77 | MLNR (0.51) | KITPTGS2PPARGMLNRNR1I2 | |
| SCHEMBL14416440 | 0.77 | MLNR (0.52) | KITPTGS2PPARGMLNRNR1I2 | |
| SCHEMBL14416441 | 0.77 | RORC (0.43) | KITPTGS2PPARGMLNRNR1I2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6512006-B1 | Novel 3-position Nitrogen substituted 6,6- disubstituted-5, 6-dihydropyrones and related compounds possess antiviral properties | WARNER-LAMBERT COMPANY | 2003-01-28 | — | — | US | disclosed |