Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.34 |
| ▸ | TYMP | P19971 | 2/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21904714 | 1.00 | BRD4 (0.35) | BRD4AKR1C3TYMPMMP3MMP8 | |
| SCHEMBL3634568 | 0.90 | TYMP (0.35) | BRD4AKR1C3TYMPMMP3MMP8 | |
| SCHEMBL16019929 | 0.89 | AKR1C3 (0.36) | BRD4AKR1C3ESR2 | |
| SCHEMBL1700787 | 0.83 | NR1H2 (0.33) | BRD4 | |
| SCHEMBL1700411 | 0.83 | NR1H2 (0.33) | BRD4 | |
| SCHEMBL624078 | 0.83 | NR1H2 (0.33) | BRD4 | |
| SCHEMBL14744107 | 0.83 | BRD4 (0.39) | BRD4AKR1C3ESR2 | |
| SCHEMBL22793007 | 0.82 | HRH3 (0.32) | — | |
| SCHEMBL22752786 | 0.80 | HTT (0.35) | — | |
| SCHEMBL17403517 | 0.78 | ATM (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3102198-A1 | ANTIDIABETIC COMPOUNDS | Merck Sharp & Dohme Corp. (US) | 2016-12-14 | — | — | EP | disclosed |
| WO-2015119899-A1 | ANTIDIABETIC COMPOUNDS | MERCK SHARP & DOHME CORP. (US) | 2015-08-13 | — | — | WO | disclosed |