Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | JAK1 | P23458 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL652814 | 1.00 | NR1H2 (0.49) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL12280107 | 0.88 | NR1H2 (0.49) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL3744107 | 0.88 | NR1H2 (0.49) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL3744110 | 0.88 | NR1H2 (0.49) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL22462855 | 0.86 | NR1H2 (0.53) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL21670174 | 0.86 | NR1H2 (0.56) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL22462856 | 0.86 | NR1H2 (0.53) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL21665989 | 0.86 | NR1H2 (0.53) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL21670176 | 0.86 | NR1H2 (0.56) | NR1H2HPGDMAPTMEN1ALDH1A1 | |
| SCHEMBL14971268 | 0.86 | NR1H2 (0.53) | NR1H2HPGDMAPTMEN1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8119635-B2 | Diazabicyclic central nervous system active agents | ABBOTT LABORATORIES (US) | 2012-02-21 | — | — | US | disclosed |
| EP-2298775-A1 | Diazabicyclic central nervous system active agents | Abbott Laboratories (US) | 2011-03-23 | — | — | EP | disclosed |
| EP-2295437-A1 | Diazabicyclic central nervous system active agents | Abbott Laboratories (US) | 2011-03-16 | — | — | EP | disclosed |