Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 6/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 3/20 | 0.36 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.36 |
| ▸ | TYK2 | P29597 | 2/20 | 0.35 |
| ▸ | JAK2 | O60674 | 3/20 | 0.35 |
| ▸ | PIM1 | P11309 | 2/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4421793 | 0.80 | GRM5 (0.46) | GRM5CYP1A2CYP11B1CYP11B2MAOB | |
| SCHEMBL8283777 | 0.73 | CYP1A2 (0.50) | GRM5CYP1A2CYP11B1CYP11B2MAOB | |
| SCHEMBL4420891 | 0.72 | AAK1 (0.46) | GRM5CYP1A2CYP11B1CYP11B2MAOB | |
| SCHEMBL5043729 | 0.70 | GRM5 (0.48) | GRM5CYP1A2MAOBMAOAMAP4K1 | |
| SCHEMBL13706992 | 0.67 | PARP1 (0.43) | GRM5CYP1A2CYP11B1CYP11B2PIM1 | |
| SCHEMBL4433324 | 0.67 | GRM5 (0.54) | GRM5MAOBMAOAMAP4K1KDM4E | |
| SCHEMBL4433682 | 0.67 | PRKDC (0.45) | GRM5CYP1A2CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL13706983 | 0.67 | USP2 (0.39) | GRM5CYP1A2CYP11B1CYP11B2HSD17B10 | |
| SCHEMBL5035615 | 0.66 | CYP1A2 (0.45) | GRM5CYP1A2CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL2652533 | 0.66 | CYP2A6 (0.58) | CYP1A2CYP11B2KDM4EHTTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1723116-B1 | TETRAHYDROQUINOLINONES AND THEIR USE AS ANTAGONISTS OF METABOTROPIC GLUTAMATE RECEPTORS | MERZ PHARMA GMBH & CO KGAA (DE) | 2008-09-24 | — | — | EP | claimed |