Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.51 |
| ▸ | CSNK1A1 | P48729 | 4/20 | 0.51 |
| ▸ | CSNK1D | P48730 | 4/20 | 0.51 |
| ▸ | GSK3B | P49841 | 4/20 | 0.51 |
| ▸ | CSNK1G2 | P78368 | 3/20 | 0.51 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.48 |
| ▸ | FASN | P49327 | 3/20 | 0.48 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL18106902 | 0.91 | NPC1 (0.49) | CSNK1A1CSNK1DGSK3BCSNK1G2IRAK4 | |
| SCHEMBL18106911 | 0.90 | ABL1 (0.46) | PIN1CSNK1A1CSNK1DGSK3BCSNK1G2 | |
| SCHEMBL18106904 | 0.86 | LPAR2 (0.48) | PIN1CSNK1A1CSNK1DGSK3BCSNK1G2 | |
| SCHEMBL18106898 | 0.84 | LPAR2 (0.66) | IRAK4NPC1RAB9ALPAR2SMN1; SMN2 | |
| SCHEMBL18106906 | 0.83 | SMN1; SMN2 (0.63) | GSK3BNPC1RAB9ALPAR2SMN1; SMN2 | |
| SCHEMBL18106893 | 0.81 | TUBB4A (0.51) | IRAK4NPC1RAB9AABL1LPAR2 | |
| SCHEMBL18106905 | 0.81 | LPAR2 (0.68) | CSNK1DLPAR2SMN1; SMN2RPS6KA2KCNH2 | |
| SCHEMBL15944999 | 0.81 | LPAR2 (0.74) | PIN1CSNK1A1CSNK1DGSK3BCSNK1G2 | |
| SCHEMBL18106895 | 0.79 | LPAR2 (0.67) | NPC1RAB9ALPAR2SMN1; SMN2 | |
| SCHEMBL15947346 | 0.77 | CSNK1A1 (0.50) | PIN1CSNK1A1CSNK1DGSK3BCSNK1G2 |
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-2742029-B1 | N-(BENZIMIMDAZOL-2-YL)-CYCLOPROPANE CARBOXAMIDES AS LYSOPHOSPHATIDIC ACID ANTAGONISTS | MERCK PATENT GMBH (DE) | 2016-10-05 | — | — | EP | claimed |