Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 2/20 | 0.52 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.36 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 5/20 | 0.35 |
| ▸ | CDK8 | P49336 | 5/20 | 0.35 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.35 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6776170 | 0.78 | DPP4 (0.35) | DPP4PDE10APDE3BPDE3A | |
| SCHEMBL28541735 | 0.70 | KDM4E (0.52) | FDPS | |
| SCHEMBL28541733 | 0.70 | KDM4E (0.52) | FDPS | |
| Trifluoroacetic Acid SCHEMBL6770800 | 0.69 | ROCK1 (0.38) | PDE10APDE3BPDE3A | |
| SCHEMBL24228802 | 0.67 | CNKSR1 (0.46) | DPP4FDPSCCNCCDK8P2RY12 | |
| SCHEMBL15019607 | 0.66 | CA12 (0.47) | DPP4FDPSCCNCCDK8CDK19 | |
| SCHEMBL15019606 | 0.66 | CA12 (0.47) | DPP4FDPSCCNCCDK8CDK19 | |
| Trifluoroacetic Acid SCHEMBL6770678 | 0.65 | F7 (0.33) | PDE10APDE3BPDE3A | |
| SCHEMBL22186887 | 0.64 | TTR (0.47) | DPP4FDPSCCNCCDK8CDK19 | |
| SCHEMBL29403887 | 0.64 | TTR (0.47) | DPP4FDPSCCNCCDK8CDK19 |
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-6825181-B1 | ORALLY ADMINISTRATED TO EXHIBIT A STRONG ANTICOAGULANT EFFECT BY INHIBITING ACTIVATED BLOOD- COAGULATION FACTOR X | AJINOMOTO CO., INC. (JP) | 2004-11-30 | — | — | US | disclosed |
| EP-1065200-A1 | AMINOISOQUINOLINE DERIVATIVES | Ajinomoto Co., Inc. (JP) | 2001-01-03 | — | — | EP | disclosed |