Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | MME | P08473 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | REN | P00797 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | PPARA | Q07869 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL11828723 | 0.81 | MAOB (0.51) | MAOBMMECYP2A6GRM2HCAR2 | |
| SCHEMBL28842558 | 0.77 | MAOB (0.58) | MAOBMMECYP2A6GRIA2GRIA4 | |
| SCHEMBL11828202 | 0.77 | MAOB (0.44) | MAOBMMECYP2A6GRIA2GRIA4 | |
| SCHEMBL6746625 | 0.77 | TRPA1 (0.44) | MAOBESR1ESR2 | |
| SCHEMBL11824499 | 0.77 | MME (0.62) | MAOBMMECYP2A6HCAR2MMP2 | |
| SCHEMBL11836497 | 0.74 | GRIA2 (0.40) | MAOBCYP2A6GRIA2GRIA4DHODH | |
| SCHEMBL11832648 | 0.73 | MAOB (0.54) | MAOBMMECYP2A6GRIA2GRIA4 | |
| SCHEMBL11829764 | 0.73 | MAOB (0.49) | MAOBMMECYP2A6DHODHGRM2 | |
| SCHEMBL15293416 | 0.73 | MAOB (0.56) | MAOBMMECYP2A6GRM2REN | |
| SCHEMBL10665717 | 0.71 | MAOB (0.63) | MAOBMMECYP2A6GRM2HCAR2 |
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-3966801-A | ANTIINFLAMMATORY AGENTS | WILLIAM H. RORER, INC. (US) | 1976-06-29 | — | — | US | disclosed |