Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | IDH1 | O75874 | 18/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4565599 | 0.84 | KEAP1 (0.48) | IDH1 | |
| SCHEMBL4553143 | 0.82 | KEAP1 (0.50) | IDH1 | |
| SCHEMBL4553795 | 0.75 | NAMPT (0.44) | — | |
| SCHEMBL3628702 | 0.75 | P2RX4 (0.46) | — | |
| SCHEMBL6168375 | 0.73 | HSD17B3 (0.49) | — | |
| SCHEMBL29493251 | 0.72 | HDAC3 (0.41) | — | |
| SCHEMBL15056964 | 0.72 | HDAC3 (0.41) | — | |
| SCHEMBL4553750 | 0.72 | HTT (0.47) | OPRM1 | |
| SCHEMBL29950507 | 0.71 | HDAC3 (0.43) | — | |
| SCHEMBL304994 | 0.71 | HDAC3 (0.43) | — |
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-2125741-A1 | TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR | Janssen Pharmaceutica, N.V. (BE) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008109336-A1 | TETRAHYDROISOQUINOLINE COMPOUNDS AS MODULATORS OF THE HISTAMINE H3 RECEPTOR | JANSSEN PHARMACEUTICA N.V. (BE) | 2008-09-12 | — | — | WO | disclosed |