Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.49 |
| ▸ | CCKAR | P32238 | 11/20 | 0.46 |
| ▸ | CCKBR | P32239 | 11/20 | 0.46 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.40 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.39 |
| ▸ | ITGA4 | P13612 | 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 | |
|---|---|---|---|---|
| SCHEMBL5926475 | 0.91 | ACLY (0.53) | ACLYCCKARCCKBRMCL1ITGB1 | |
| SCHEMBL5926535 | 0.89 | ACLY (0.50) | ACLYCCKARCCKBRPSMB5MCL1 | |
| SCHEMBL8337522 | 0.83 | MMP2 (0.47) | CCKARCCKBRMCL1KCNA5MMP1 | |
| SCHEMBL8339983 | 0.82 | CCKAR (0.54) | CCKARCCKBRMCL1ITGB1ITGA4 | |
| SCHEMBL5926353 | 0.82 | CCKAR (0.54) | CCKARCCKBRMCL1ITGB1ITGA4 | |
| SCHEMBL5926476 | 0.82 | ACLY (0.52) | ACLYCCKARCCKBRMCL1KCNA5 | |
| SCHEMBL5926538 | 0.81 | ACLY (0.50) | ACLYKCNA5 | |
| SCHEMBL6097972 | 0.81 | ACLY (0.53) | ACLYCCKARCCKBRITGB1ITGA4 | |
| SCHEMBL5927106 | 0.78 | CCKAR (0.53) | ACLYCCKARCCKBRMCL1KCNA5 | |
| SCHEMBL8338082 | 0.77 | — | — |
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-2004014844-A2 | ARYL AND HETEROARYL COMPOUNDS AND METHODS TO MODULATE COAGULATION | TRANSTECH PHARMA, INC. (US) | 2004-02-19 | — | — | WO | disclosed |