Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 10/20 | 0.40 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TOP1 | P11387 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | IDH2 | P48735 | 3/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10102644 | 0.85 | GPBAR1 (0.42) | GPBAR1GRM1KDM4ETOP1GAA | |
| SCHEMBL13005203 | 0.74 | AKT1 (0.36) | KDM4EL3MBTL1 | |
| SCHEMBL10102638 | 0.74 | GPBAR1 (0.42) | GPBAR1GRM1BACE1 | |
| SCHEMBL10107979 | 0.71 | GRM1 (0.39) | GPBAR1GRM1TOP1GAAPOLB | |
| SCHEMBL13004928 | 0.71 | DHODH (0.46) | KDM4E | |
| SCHEMBL10102671 | 0.70 | DHODH (0.46) | KDM4EBACE1 | |
| SCHEMBL10102661 | 0.70 | GPBAR1 (0.41) | GPBAR1GRM1BACE1 | |
| SCHEMBL13005263 | 0.70 | DHFR (0.40) | KDM4EBACE1 | |
| SCHEMBL10102660 | 0.69 | IDO1 (0.44) | GPBAR1GRM1 | |
| SCHEMBL4743270 | 0.69 | GPBAR1 (0.64) | GPBAR1GRM1TOP1 |
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-1891011-B1 | TETRAHYDROQUINOLINES USED IN THE FORM OF MODULATORS OF MITOTIC MOTOR-PROTEINS EG5 | MERCK PATENT GMBH (DE) | 2010-12-08 | — | — | EP | disclosed |