Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.40 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.40 |
| ▸ | ITGAL | P20701 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.37 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.36 |
| ▸ | HRH1 | P35367 | 3/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7652262 | 0.89 | NOX4 (0.45) | KDM4ENOX4LMNAADRA1AHRH1 | |
| SCHEMBL7649212 | 0.84 | CTSK (0.47) | KDM4EHTTLMNAMEN1KMT2A | |
| Dimethylamine SCHEMBL7652932 | 0.82 | L3MBTL1 (0.42) | KDM4EHTTHSD11B1LMNAALOX12 | |
| SCHEMBL7652938 | 0.81 | ALDH1A1 (0.43) | KDM4ELMNAADRA1AHRH1OPRM1 | |
| SCHEMBL7649148 | 0.81 | HTT (0.47) | KDM4EHTTHSD11B1LMNAALOX12 | |
| SCHEMBL7656105 | 0.80 | DRD2 (0.39) | KDM4ELMNAADRA1AHRH1OPRM1 | |
| SCHEMBL7651062 | 0.80 | CA1 (0.37) | KDM4EHTTLMNANPSR1OPRM1 | |
| SCHEMBL7656086 | 0.80 | CTSK (0.45) | KDM4EADORA3CYP3A4MAPK1MEN1 | |
| SCHEMBL7653733 | 0.79 | NPC1 (0.40) | KDM4ELMNANPSR1ADRA1AHRH1 | |
| SCHEMBL7653997 | 0.79 | OPRM1 (0.38) | KDM4ELMNAADRA1AHRH1OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6492407-B2 | NEUROPROTECTIVE ACTIVITY | BOEHRINGER IMGELHEIM PHARMA KG (DE) | 2002-12-10 | — | — | US | disclosed |