Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.35 |
| ▸ | BCAT1 | P54687 | 2/20 | 0.33 |
| ▸ | PYGL | P06737 | 2/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP4 | P49662 | 1/20 | 0.31 |
| ▸ | CASP5 | P51878 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | CASP9 | P55211 | 1/20 | 0.31 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.31 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 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 | |
|---|---|---|---|---|
| SCHEMBL4058202 | 0.92 | ALB (0.38) | DPP4CYP51A1 | |
| SCHEMBL4057673 | 0.90 | PYGL (0.39) | BCAT1PYGLCYP51A1EGFR | |
| SCHEMBL4051117 | 0.88 | ALOX15 (0.42) | BCAT1PYGLCYP51A1 | |
| SCHEMBL8007197 | 0.87 | CCR1 (0.33) | CCR1BCAT1PYGL | |
| SCHEMBL4052843 | 0.85 | PYGL (0.41) | BCAT1PYGLCYP51A1 | |
| SCHEMBL4057362 | 0.84 | PYGL (0.39) | BCAT1PYGLCYP51A1EGFR | |
| SCHEMBL4050168 | 0.82 | DRD2 (0.36) | PYGLCYP51A1 | |
| SCHEMBL4052196 | 0.82 | DRD4 (0.38) | PYGLCYP51A1EGFRNR1H2NR1H3 | |
| SCHEMBL4051255 | 0.82 | CCR1 (0.41) | CCR1DPP4CASP1CASP4CASP5 | |
| SCHEMBL4059459 | 0.80 | PYGL (0.38) | BCAT1PYGLCYP51A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009111680-A1 | TRPV4 ANTAGONISTS | SMITHLINE BEECHAM CORPORATION (US) | 2009-09-11 | — | — | WO | claimed |
| WO-2009111680-A1 | TRPV4 ANTAGONISTS | SMITHLINE BEECHAM CORPORATION (US) | 2009-09-11 | — | — | WO | disclosed |