Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4769599 | 1.00 | NCOA1 (0.39) | NCOA1NCOA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4767911 | 0.94 | NCOA1 (0.42) | NCOA1NCOA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4767902 | 0.94 | NCOA1 (0.42) | NCOA1NCOA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4763574 | 0.92 | SMN1; SMN2 (0.41) | NPC1RAB9ASMN1; SMN2ADORA2AADORA2B | |
| SCHEMBL4763559 | 0.92 | SMN1; SMN2 (0.41) | NPC1RAB9ASMN1; SMN2ADORA2AADORA2B | |
| SCHEMBL4763475 | 0.88 | NCOA1 (0.42) | NCOA1NCOA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4793245 | 0.87 | NPC1 (0.36) | NPC1RAB9ASMN1; SMN2ADORA2AADORA2B | |
| SCHEMBL4793254 | 0.87 | NPC1 (0.36) | NPC1RAB9ASMN1; SMN2ADORA2AADORA2B | |
| SCHEMBL4763471 | 0.86 | NCOA1 (0.42) | NCOA1NCOA3NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL4763478 | 0.86 | NCOA1 (0.42) | NCOA1NCOA3NPC1RAB9ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1678181-B1 | A2B ADENOSINE RECEPTOR ANTAGONISTS | CV THERAPEUTICS INC (US) | 2008-12-31 | — | — | EP | disclosed |