Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGPAT2 | O15120 | 7/20 | 0.52 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.50 |
| ▸ | PTGER1 | P34995 | 3/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.45 |
| ▸ | EIF4EBP1 | Q13541 | 3/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL17595083 | 0.87 | AGPAT2 (0.50) | AGPAT2PTGDR2DHFR | |
| SCHEMBL21044491 | 0.85 | ALDH1A1 (0.55) | AGPAT2 | |
| Trifluoroacetic Acid SCHEMBL5389154 | 0.78 | AGPAT2 (0.60) | AGPAT2PTGDR2SLC9A1DHFR | |
| SCHEMBL20515862 | 0.77 | TSHR (0.48) | MRGPRX4 | |
| SCHEMBL5377655 | 0.76 | GABRA2 (0.47) | AGPAT2 | |
| SCHEMBL945720 | 0.76 | TSHR (0.65) | PTGER1MRGPRX4 | |
| SCHEMBL411891 | 0.76 | MAP4K4 (0.49) | PTGDR2S1PR1 | |
| SCHEMBL19579748 | 0.76 | ALOX15 (0.49) | MRGPRX4 | |
| SCHEMBL24769302 | 0.73 | POLQ (0.61) | AGPAT2PTGDR2PTGER1MRGPRX4SLC9A1 | |
| SCHEMBL30017799 | 0.73 | POLQ (0.61) | AGPAT2PTGDR2PTGER1MRGPRX4SLC9A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3191451-B1 | 4-SUBSTITUTED PYRIDINE-2,6-DICARBOXYLIC ACID DERIVATIVES AND METHOD OF PREPARING SAME | OKINAWA INST SCIENCE & TECH SCHOOL CORP (JP) | 2019-06-05 | — | — | EP | claimed |