Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 3/20 | 0.51 |
| ▸ | HTT | P42858 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | PPM1B | O75688 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1026891 | 0.84 | HTT (0.64) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1027576 | 0.84 | HTT (0.64) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1030180 | 0.80 | POLB (0.51) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1030181 | 0.80 | POLB (0.51) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1026892 | 0.77 | RAB9A (0.46) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1030070 | 0.76 | KMT2A (0.47) | RAB9APOLBHTTALDH1A1LMNA | |
| SCHEMBL1031345 | 0.74 | RAB9A (0.43) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1031344 | 0.74 | RAB9A (0.43) | RAB9APOLBHTTNPC1ALDH1A1 | |
| SCHEMBL1027596 | 0.73 | F10 (0.67) | F10 | |
| SCHEMBL12955649 | 0.72 | L3MBTL1 (0.53) | RAB9APOLBHTTNPC1ALDH1A1 |
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-1814855-B1 | DICARBOXAMIDE DERIVATIVES AND THEIR USE AS FACTOR XA INHIBITORS | HOFFMANN LA ROCHE (CH) | 2011-01-19 | — | — | EP | disclosed |