Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP10 | Q53GL7 | 10/20 | 0.58 |
| ▸ | CA2 | P00918 | 3/20 | 0.58 |
| ▸ | PARP1 | P09874 | 2/20 | 0.58 |
| ▸ | PARP4 | Q9UKK3 | 2/20 | 0.58 |
| ▸ | CA1 | P00915 | 2/20 | 0.58 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| Trimethylammonium SCHEMBL4471719 | 0.90 | PARP10 (0.55) | PARP10CA2PARP1PARP4CA1 | |
| Terephthalamide SCHEMBL23774 | 0.87 | PARP1 (0.71) | PARP10CA2PARP1PARP4CA1 | |
| Benzamide SCHEMBL3897344 | 0.87 | PARP1 (0.80) | PARP10CA2PARP1PARP4CA1 | |
| Trimethylammonium SCHEMBL11185601 | 0.86 | NOS1 (0.48) | PARP10CA2PARP1PARP4CA1 | |
| Benzamide SCHEMBL27929286 | 0.85 | PARP1 (0.76) | PARP10CA2PARP1PARP4CA1 | |
| Benzamide SCHEMBL27929288 | 0.85 | PARP1 (0.76) | PARP10CA2PARP1PARP4CA1 | |
| SCHEMBL632045 | 0.85 | ALDH1A1 (0.67) | PARP10CA2PARP1PARP4CA1 | |
| SCHEMBL1004065 | 0.85 | ALDH1A1 (0.59) | PARP10CA2PARP1PARP4CA1 | |
| Terephthalamide SCHEMBL11512422 | 0.84 | PARP1 (0.67) | PARP10CA2PARP1PARP4CA1 | |
| Terephthalamide SCHEMBL7508927 | 0.84 | PARP1 (0.67) | PARP10CA2PARP1PARP4CA1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101531631-A | Substituted pyridinones as modulators of p38 map kinase | PHARMACIA CORP (US) | 2009-09-16 | — | — | CN | claimed |
| CN-102964294-A | Pyridyl inhibitors of hedgehog signalling | GENENTECH INC | 2013-03-13 | — | — | CN | disclosed |
| CN-102083822-A | Pyridyl inhibitors of HEDGEHOG signalling | GENENTECH INC | 2011-06-01 | — | — | CN | disclosed |
| CN-101072755-A | Pyridyl inhibitors of Hedgehog signaling | GENENTECH INC (US) | 2007-11-14 | — | — | CN | disclosed |
| CN-101031555-A | Thiazole derivative capable of vap-1 inhibitory activity | ASTELLAS PHARMA INC (JP) | 2007-09-05 | — | — | CN | disclosed |
| CN-1968937-A | Pyrimidin-4-one derivatives and their use as P38 kinase modulators | PHARMACIA CORP (US) | 2007-05-23 | — | — | CN | disclosed |