Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | CCR2 | P41597 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | PLK1 | P53350 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | FEN1 | P39748 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | CLPP | Q16740 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8440634 | 0.95 | CFTR (0.48) | CFTRALDH1A1HDAC8HDAC6HDAC1 | |
| SCHEMBL8916695 | 0.93 | CFTR (0.49) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL8908061 | 0.90 | CFTR (0.57) | CFTRALDH1A1HDAC8HDAC6CCR2 | |
| SCHEMBL8439957 | 0.90 | CFTR (0.58) | CFTRALDH1A1HDAC8HDAC6CCR2 | |
| SCHEMBL8487543 | 0.83 | CFTR (0.54) | CFTRALDH1A1HDAC8HDAC6CCR2 | |
| SCHEMBL8441589 | 0.81 | CFTR (0.49) | CFTRHDAC8HDAC6HDAC1CNR1 | |
| SCHEMBL8907770 | 0.81 | CFTR (0.49) | CFTRALDH1A1HDAC8HDAC6CCR2 | |
| SCHEMBL8440897 | 0.80 | CFTR (0.51) | CFTRALDH1A1HDAC8HDAC6CCR2 | |
| SCHEMBL8443423 | 0.78 | CFTR (0.52) | CFTRALDH1A1HDAC8HDAC6CCR2 | |
| SCHEMBL8440689 | 0.77 | HDAC8 (0.49) | CFTRALDH1A1HDAC8HDAC6CCR2 |
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-5612363-A | FACTOR XA INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1997-03-18 | — | — | US | disclosed |