Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIG1 | P18858 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 3/20 | 0.41 |
| ▸ | RCOR1 | Q9UKL0 | 3/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 9/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | CCR2 | P41597 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5266179 | 0.82 | MAPK1 (0.49) | KDM1AMAPK1CYP2C19 | |
| SCHEMBL28876302 | 0.76 | LIG1 (0.44) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL17984248 | 0.76 | KDM1A (0.44) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL28065197 | 0.76 | KDM1A (0.44) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL16455153 | 0.76 | KDM1A (0.44) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL19385670 | 0.74 | LIG1 (0.41) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL19385671 | 0.74 | LIG1 (0.41) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL4134830 | 0.74 | KDM1A (0.41) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL5899615 | 0.73 | KDM1A (0.44) | LIG1KDM1ARCOR1PTGS2HSD11B1 | |
| SCHEMBL15797670 | 0.71 | KDM1A (0.44) | KDM1ARCOR1 |
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-2729447-A1 | POSITIVE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTOR | H. Lundbeck A/S (DK) | 2014-05-14 | — | — | EP | disclosed |
| WO-2013007621-A1 | POSITIVE ALLOSTERIC MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTOR | H. LUNDBECK A/S (DK) | 2013-01-17 | — | — | WO | disclosed |