Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.61 |
| ▸ | RAB9A | P51151 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | DRD3 | P35462 | 4/20 | 0.51 |
| ▸ | DRD2 | P14416 | 3/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL21806100 | 0.83 | HDAC3 (0.49) | HPGDRAB9ANPC1SMN1; SMN2HTT | |
| SCHEMBL13248219 | 0.81 | ADORA3 (0.55) | HPGDNPC1SMN1; SMN2HTTALDH1A1 | |
| SCHEMBL13056379 | 0.81 | ADORA3 (0.55) | NPC1SMN1; SMN2ADORA3ADORA2AADORA2B | |
| SCHEMBL13248218 | 0.80 | ADORA3 (0.54) | HPGDNPC1SMN1; SMN2TP53ADORA3 | |
| SCHEMBL24012380 | 0.79 | MAOB (0.50) | RAB9ANPC1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL13248222 | 0.79 | ADORA3 (0.56) | HPGDNPC1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL13753935 | 0.79 | ADORA3 (0.65) | HPGDALDH1A1MAPTTP53ADORA3 | |
| SCHEMBL13056382 | 0.78 | HDAC3 (0.50) | HPGDNPC1SMN1; SMN2ALDH1A1ADORA3 | |
| SCHEMBL30265292 | 0.76 | HTT (0.64) | HPGDRAB9ANPC1SMN1; SMN2HTT | |
| SCHEMBL6028978 | 0.76 | ADORA3 (0.62) | HPGDRAB9ANPC1ALDH1A1MAPT |
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-20210349101-A1 | COUMARIN-BASED CROSSLINKING REAGENTS | VENTANA MEDICAL SYSTEMS, INC. | 2021-11-11 | — | — | US | disclosed |