Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 3/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 9/20 | 0.34 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.34 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 3/20 | 0.32 |
| ▸ | NTSR1 | P30989 | 3/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18092180 | 1.00 | IDH1 (0.37) | IDH1FFAR4P2RY12DGAT2KDM1A | |
| SCHEMBL4860338 | 0.90 | PDE4B (0.39) | IDH1 | |
| SCHEMBL4860342 | 0.90 | PDE4B (0.39) | IDH1 | |
| SCHEMBL4849367 | 0.85 | IDH1 (0.36) | IDH1NTSR1 | |
| SCHEMBL4849357 | 0.85 | IDH1 (0.36) | IDH1NTSR1 | |
| SCHEMBL4852545 | 0.85 | IDH1 (0.34) | IDH1NTSR1 | |
| SCHEMBL4852535 | 0.85 | IDH1 (0.34) | IDH1NTSR1 | |
| SCHEMBL14064742 | 0.84 | USP30 (0.40) | — | |
| Hydrochloric Acid SCHEMBL4851030 | 0.84 | IDH1 (0.34) | IDH1NTSR1 | |
| Hydrochloric Acid SCHEMBL4857620 | 0.84 | IDH1 (0.34) | IDH1NTSR1 |
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-1698620-B1 | BENZENE COMPOUNDS DISUBSTITUTED WITH CYCLIC GROUPS AT THE 1- AND 2-POSITIONS | EISAI R&D MAN CO LTD (JP) | 2016-09-28 | — | — | EP | disclosed |