Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 6/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 6/20 | 0.40 |
| ▸ | DHODH | Q02127 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 2/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 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 | |
|---|---|---|---|---|
| SCHEMBL4682467 | 0.91 | HSD17B1 (0.45) | HSD17B1HSD17B2DHODHCYP3A4CYP2C9 | |
| SCHEMBL4420091 | 0.86 | BRD4 (0.39) | HSD17B1HSD17B2DHODHCYP3A4CYP2C9 | |
| SCHEMBL4433048 | 0.84 | HSD17B1 (0.53) | HSD17B1HSD17B2CYP3A4CYP2C9GRM5 | |
| SCHEMBL4428642 | 0.84 | GRM5 (0.47) | HSD17B1HSD17B2DHODHCYP3A4CYP2C9 | |
| SCHEMBL4426626 | 0.84 | GRM5 (0.47) | HSD17B1HSD17B2CYP3A4CYP2C9GRM5 | |
| SCHEMBL4423811 | 0.81 | KDM1A (0.37) | DHODHCYP3A4GRM5TP53MAPT | |
| SCHEMBL4418704 | 0.79 | NPC1 (0.39) | DHODHGRM5MAPT | |
| SCHEMBL4419454 | 0.78 | CYP1A1 (0.36) | CYP3A4CYP2C9GRM5MAPT | |
| SCHEMBL4679273 | 0.78 | DHODH (0.41) | HSD17B1HSD17B2DHODHCYP3A4CYP2C9 | |
| SCHEMBL4683023 | 0.75 | GRM5 (0.43) | GRM5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1943247-A1 | TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | Merz Pharma GmbH & Co.KGaA (DE) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007023245-A1 | TETRAHYDROQUINOLINONES AND THEIR USE AS MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2007-03-01 | — | — | WO | disclosed |