Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.33 |
| ▸ | PTGES | O14684 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 5/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8818531 | 0.86 | CHEK2 (0.41) | PPARGPPARACYP1A2CYP2D6CYP3A4 | |
| SCHEMBL8818545 | 0.85 | DYRK3 (0.45) | PPARGPPARACYP1A2CYP2D6CYP3A4 | |
| SCHEMBL8818801 | 0.83 | ACHE (0.44) | PPARGPPARACYP1A2CYP2D6CYP3A4 | |
| SCHEMBL8916509 | 0.81 | DHODH (0.36) | PPARGPPARACYP1A2CYP2D6LMNA | |
| SCHEMBL8818927 | 0.78 | MGAM (0.41) | MGAMGAASIMGAM2NR1I3 | |
| SCHEMBL8817526 | 0.77 | NR1I3 (0.34) | MGAMGAASIMGAM2NR1I3 | |
| SCHEMBL8816636 | 0.76 | ACHE (0.39) | MGAMGAASIMGAM2NR1H2 | |
| SCHEMBL8818920 | 0.75 | DHODH (0.42) | PPARGPPARAMGAMGAASI | |
| SCHEMBL8816922 | 0.75 | ACHE (0.43) | MGAMGAASIMGAM2PRMT5 | |
| SCHEMBL8891323 | 0.74 | DHODH (0.42) | PPARGPPARAMGAMGAASI |
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-1997033873-A1 | METHODS OF TREATING OR PREVENTING INTERSTITIAL CYSTITIS | ELI LILLY AND COMPANY (US) | 1997-09-18 | — | — | WO | disclosed |