Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | ACP1 | P24666 | 2/20 | 0.46 |
| ▸ | KLK7 | P49862 | 1/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7558043 | 0.80 | ROCK2 (0.43) | KMT2AACP1ROCK2CHRNB2CHRNB4 | |
| SCHEMBL7567797 | 0.77 | MME (0.51) | KMT2AACP1KLK7CHRNB2CHRNB4 | |
| SCHEMBL7976749 | 0.76 | HDAC3 (0.43) | ROCK2 | |
| SCHEMBL6508976 | 0.74 | KMT2A (0.67) | KMT2AACP1KLK7ROCK2CHRNB2 | |
| SCHEMBL7567808 | 0.72 | KMT2A (0.60) | KMT2AACP1KLK7ROCK2CHRNB2 | |
| SCHEMBL7494122 | 0.69 | HDAC6 (0.49) | KMT2AROCK2 | |
| SCHEMBL7494113 | 0.69 | KLK7 (0.40) | KLK7 | |
| SCHEMBL7560690 | 0.69 | NCOA1 (0.42) | KMT2AACP1ROCK2CHRNB2CHRNA4 | |
| SCHEMBL7492816 | 0.69 | KMT2A (0.51) | KMT2AACP1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL7563657 | 0.68 | KLK7 (0.40) | KLK7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002069895-A2 | HETEROCYCLIC ANALGESIC COMPOUNDS AND METHODS OF USE THEREOF | SEPRACOR, INC. (US) | 2002-09-12 | — | — | WO | disclosed |