Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.38 |
| ▸ | NQO1 | P15559 | 1/20 | 0.38 |
| ▸ | POR | P16435 | 1/20 | 0.38 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.38 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NNMT | P40261 | 1/20 | 0.37 |
| ▸ | GABRP | O00591 | 1/20 | 0.37 |
| ▸ | GABRD | O14764 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5614036 | 0.98 | PARP1 (0.41) | PARP1MAPK8HSD17B1NPC1RAB9A | |
| SCHEMBL22067721 | 0.87 | MAPK8 (0.39) | PARP1MAPK8NPC1RAB9ATAAR1 | |
| SCHEMBL4638489 | 0.86 | PARP1 (0.46) | PARP1MAPK8NPC1RAB9ATAAR1 | |
| SCHEMBL31534041 | 0.83 | HSD17B1 (0.42) | HSD17B1NPC1RAB9ACSNK2A1CYP1A2 | |
| SCHEMBL21356997 | 0.83 | TAAR1 (0.56) | PARP1MAPK8TAAR1CYP1A2MEN1 | |
| SCHEMBL4976602 | 0.83 | MAPK8 (0.39) | PARP1MAPK8NPC1RAB9ATAAR1 | |
| SCHEMBL5803208 | 0.82 | POLB (0.49) | PARP1MAPK8NPC1RAB9ATAAR1 | |
| SCHEMBL6022904 | 0.82 | TAAR1 (0.42) | PARP1MAPK8NPC1RAB9ATAAR1 | |
| SCHEMBL9217873 | 0.82 | HSD17B1 (0.58) | HSD17B1NPC1RAB9ACSNK2A1CYP1A2 | |
| SCHEMBL1549076 | 0.82 | CSNK2A1 (0.53) | HSD17B1CSNK2A1CYP1A2GABRPGABRD |
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 |
|---|---|---|---|---|---|---|---|
| EP-1915350-A1 | AMIDE DERIVATIVES | AstraZeneca AB (SE) | 2008-04-30 | — | — | EP | disclosed |
| WO-2007020411-A1 | AMIDE DERIVATIVES | ASTRAZENECA AB (SE) | 2007-02-22 | — | — | WO | disclosed |