Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 1/20 | 0.59 |
| ▸ | MMP2 | P08253 | 5/20 | 0.49 |
| ▸ | MMP3 | P08254 | 2/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | CPA1 | P15085 | 3/20 | 0.47 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CPB2 | Q96IY4 | 2/20 | 0.45 |
| ▸ | CPB1 | P15086 | 1/20 | 0.45 |
| ▸ | CPA3 | P15088 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8476501 | 0.90 | CPA1 (0.50) | GRIK1CPA1CYP1A2CPB2CPB1 | |
| SCHEMBL7319632 | 0.85 | GRIK1 (0.64) | GRIK1MMP2MMP3CPA1CPB2 | |
| SCHEMBL1856639 | 0.84 | GRIK1 (0.72) | GRIK1MMP2MMP3MMP1MMP9 | |
| SCHEMBL1860416 | 0.81 | GRIK1 (0.68) | GRIK1MMP2MMP3MMP1MMP9 | |
| SCHEMBL8473749 | 0.81 | TRPA1 (0.54) | GRIK1CPA1FOLH1TRPA1CPB2 | |
| SCHEMBL7861733 | 0.81 | TSHR (0.66) | GRIK1MMP2MMP3MMP1MMP9 | |
| SCHEMBL10521966 | 0.80 | FOLH1 (0.72) | GRIK1CPA1FOLH1CYP1A2CPB2 | |
| SCHEMBL18241165 | 0.80 | GRIK1 (0.66) | GRIK1MMP2MMP3MMP1MMP9 | |
| SCHEMBL18241164 | 0.80 | GRIK1 (0.66) | GRIK1MMP2MMP3MMP1MMP9 | |
| SCHEMBL10769990 | 0.80 | FOLH1 (0.72) | GRIK1CPA1FOLH1CYP1A2CPB2 |
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-1028716-A1 | METHOD FOR TREATING AND PREVENTING HEART FAILURE AND VENTRICULAR DILATATION | WARNER-LAMBERT COMPANY (US) | 2000-08-23 | — | — | EP | disclosed |
| WO-1998025597-A2 | METHOD FOR TREATING AND PREVENTING HEART FAILURE AND VENTRICULAR DILATATION | WARNER-LAMBERT COMPANY (US) | 1998-06-18 | — | — | WO | disclosed |