Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 12/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | IL6ST | P40189 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.34 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.34 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL46343 | 0.85 | IDH1 (0.44) | IDH1NAAAIL6STFAAHPPARA | |
| SCHEMBL3747623 | 0.80 | CACNA2D1 (0.45) | IDH1NAAAPPARA | |
| SCHEMBL3747620 | 0.80 | CACNA2D1 (0.45) | IDH1NAAAPPARA | |
| SCHEMBL13654970 | 0.80 | PPARA (0.37) | IDH1NAAAIL6STPPARACSNK2B | |
| SCHEMBL9962996 | 0.78 | AGTR2 (0.35) | IDH1IL6STFAAHPPARACSNK2B | |
| SCHEMBL1049822 | 0.76 | NAAA (0.46) | IDH1NAAAIL6STFAAHPPARA | |
| SCHEMBL2029159 | 0.76 | NAAA (0.46) | IDH1NAAAIL6STFAAHPPARA | |
| SCHEMBL1049820 | 0.76 | NAAA (0.46) | IDH1NAAAIL6STFAAHPPARA | |
| SCHEMBL17241988 | 0.76 | IDH1 (0.45) | IDH1NAAAIL6STFAAHPPARA | |
| SCHEMBL17241987 | 0.76 | IDH1 (0.45) | IDH1NAAAIL6STFAAHPPARA |
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-2011025774-A1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2011-03-03 | — | — | WO | disclosed |