Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 10/20 | 0.42 |
| ▸ | MTNR1B | P49286 | 10/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | PLAT | P00750 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | CASP7 | P55210 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6769241 | 0.96 | ROCK1 (0.45) | ROCK1MTNR1AMTNR1BPLAUPLAT | |
| Trifluoroacetic Acid SCHEMBL6890249 | 0.79 | F10 (0.49) | ROCK1MTNR1AMTNR1BF10 | |
| SCHEMBL6775414 | 0.79 | ROCK1 (0.41) | ROCK1PLAUF10ALDH1A1 | |
| SCHEMBL6769265 | 0.79 | PLAU (0.43) | ROCK1MTNR1AMTNR1BPLAUPLAT | |
| Trifluoroacetic Acid SCHEMBL6770182 | 0.78 | NPC1 (0.42) | F10ALDH1A1 | |
| SCHEMBL7120850 | 0.78 | ROCK1 (0.45) | ROCK1PLAUPLATNCF1F10 | |
| Trifluoroacetic Acid SCHEMBL6769455 | 0.77 | F10 (0.45) | PLAUNAMPTF10 | |
| Trifluoroacetic Acid SCHEMBL6775993 | 0.77 | F10 (0.42) | F10ALDH1A1 | |
| SCHEMBL6982099 | 0.76 | F12 (0.44) | ROCK1PLAUPLATNCF1F10 | |
| Trifluoroacetic Acid SCHEMBL6765882 | 0.76 | F10 (0.56) | F10ALDH1A1 |
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 |