Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 2/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.34 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.34 |
| ▸ | KIT | P10721 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.34 |
| ▸ | AKT1 | P31749 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL16754346 | 1.00 | IDH2 (0.40) | IDH2TRPV1NR3C2BTKGRM5 | |
| SCHEMBL17618458 | 0.95 | TRPV1 (0.41) | IDH2TRPV1NR3C2TRPM8CYP2C19 | |
| SCHEMBL20733227 | 0.91 | IDH2 (0.40) | IDH2NR3C2CYP2C19PIK3CAGRM2 | |
| SCHEMBL16754635 | 0.91 | FAAH (0.42) | IDH2NR3C2CYP2C19PIK3CAGRM2 | |
| SCHEMBL16754405 | 0.90 | NR3C2 (0.38) | IDH2NR3C2CYP2C19PIK3CAGRM2 | |
| SCHEMBL17778304 | 0.90 | NR3C2 (0.38) | IDH2NR3C2CYP2C19PIK3CAGRM2 | |
| SCHEMBL16754649 | 0.90 | NR3C2 (0.38) | IDH2NR3C2CYP2C19PIK3CAGRM2 | |
| SCHEMBL17618904 | 0.89 | KDM4E (0.42) | IDH2TRPV1BTKTRPM8KDM4E | |
| SCHEMBL17769364 | 0.89 | KDM4E (0.42) | IDH2TRPV1BTKTRPM8KDM4E | |
| SCHEMBL19365675 | 0.89 | KDM4E (0.42) | IDH2TRPV1BTKTRPM8KDM4E |
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-2016079711-A1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2016-05-26 | — | — | WO | disclosed |