Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 3/20 | 0.54 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.54 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.48 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.41 |
| ▸ | UGCG | Q16739 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7659194 | 0.82 | ALDH1A1 (0.51) | ADORA2AMGLLALDH1A1KDM4EMAPT | |
| SCHEMBL7656700 | 0.80 | ADORA3 (0.47) | ADORA1ADORA3ADORA2AAVPR2AVPR1A | |
| SCHEMBL7660359 | 0.79 | MGLL (0.44) | ADORA2AMGLLALDH1A1MAPTTSHR | |
| SCHEMBL7652883 | 0.79 | OPRM1 (0.41) | ADORA2AMGLLALDH1A1NPC1RAB9A | |
| SCHEMBL7652394 | 0.79 | HSD11B1 (0.45) | ADORA2AMGLL | |
| SCHEMBL7658070 | 0.79 | NPC1 (0.44) | MGLLALDH1A1NPC1RAB9ANPSR1 | |
| Dimethylamine SCHEMBL7656702 | 0.79 | ADORA3 (0.48) | ADORA1ADORA3ADORA2AAVPR2AVPR1A | |
| SCHEMBL1784121 | 0.77 | MGLL (0.46) | ADORA1ADORA3ADORA2AMGLLALDH1A1 | |
| SCHEMBL7652545 | 0.77 | ADORA3 (0.49) | ADORA1ADORA3ADORA2AALDH1A1NPC1 | |
| Dimethylamine SCHEMBL7656223 | 0.76 | MGLL (0.41) | ADORA2AMGLLALDH1A1MAPTTSHR |
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 |