Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.67 |
| ▸ | CNR2 | P34972 | 5/20 | 0.42 |
| ▸ | MDH1 | P40925 | 1/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13918361 | 1.00 | CYSLTR2 (0.67) | CYSLTR2CNR2MDH1THRATHRB | |
| SCHEMBL13918369 | 1.00 | CYSLTR2 (0.67) | CYSLTR2CNR2MDH1THRATHRB | |
| SCHEMBL13918313 | 0.93 | CYSLTR2 (0.61) | CYSLTR2CNR2MDH1CNR1 | |
| SCHEMBL4521894 | 0.93 | CYSLTR2 (0.78) | CYSLTR2 | |
| SCHEMBL4522542 | 0.92 | CYSLTR2 (0.63) | CYSLTR2CNR2 | |
| SCHEMBL4524350 | 0.92 | CYSLTR2 (0.74) | CYSLTR2 | |
| SCHEMBL13918306 | 0.91 | CYSLTR2 (0.61) | CYSLTR2CNR2MDH1 | |
| SCHEMBL13932995 | 0.91 | CYSLTR2 (0.75) | CYSLTR2 | |
| SCHEMBL4522056 | 0.91 | CYSLTR2 (0.65) | CYSLTR2 | |
| SCHEMBL4530062 | 0.90 | CYSLTR2 (0.78) | CYSLTR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7498460-B2 | Isophthalic acid derivatives | BAYER HEALTHCARE AG (DE) | 2009-03-03 | — | — | US | disclosed |
| US-7498460-B2 | Isophthalic acid derivatives | BAYER HEALTHCARE AG (DE) | 2009-03-03 | — | — | US | disclosed |