Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.40 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 7/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9753986 | 1.00 | MME (0.44) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL7815803 | 0.90 | MME (0.40) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL7815799 | 0.90 | MME (0.40) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL2572010 | 0.86 | MME (0.52) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL633444 | 0.84 | MME (0.48) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL9710320 | 0.83 | MME (0.51) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL1895025 | 0.82 | MME (0.46) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL9710577 | 0.82 | MME (0.50) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL9710219 | 0.82 | MME (0.50) | MMEFFAR1AKR1B1PTPN1ITGB1 | |
| SCHEMBL1371403 | 0.81 | MME (0.48) | MMEFFAR1AKR1B1PTPN1ITGB1 |
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-1991015479-A1 | SUBSTITUTED PYRAZOLES, ISOXAZOLES AND ISOTHIAZOLES | MERCK & CO., INC. (US) | 1991-10-17 | — | — | WO | disclosed |