Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.47 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.44 |
| ▸ | SMARCA2 | P51531 | 1/20 | 0.42 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | BLM | P54132 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5065232 | 0.74 | ADORA1 (0.43) | PDPK1ADORA2AADORA1ADORA2BSMARCA2 | |
| SCHEMBL7260786 | 0.70 | POLB (0.52) | PDPK1ADORA2AADORA1TAAR1ALDH1A1 | |
| SCHEMBL6003619 | 0.70 | KDR (0.38) | PDPK1ALDH1A1MAPTHSD17B10KDM4E | |
| SCHEMBL28457537 | 0.69 | ADORA2A (0.47) | PDPK1ADORA2AADORA1ADORA2BSMARCA2 | |
| SCHEMBL625453 | 0.69 | ALDH1A1 (0.47) | ADORA2AADORA1ADORA2BSMARCA2PBRM1 | |
| SCHEMBL16600588 | 0.69 | TAAR1 (0.50) | PDPK1ADORA2AADORA1ADORA2BSMARCA2 | |
| SCHEMBL11624096 | 0.68 | KDM4E (0.50) | PDPK1ADORA2AADORA1ADORA2BALDH1A1 | |
| SCHEMBL4008741 | 0.67 | GAA (0.38) | PDPK1ADORA2AADORA1ADORA2BALDH1A1 | |
| SCHEMBL397270 | 0.67 | ALDH1A1 (0.52) | PDPK1ADORA2AADORA1ADORA2BSMARCA2 | |
| SCHEMBL544598 | 0.67 | MAP4K4 (0.48) | SMARCA2PBRM1ALDH1A1HSD17B10KDM4E |
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-4521422-A | ANTICONVULSANT, ANTIEPILEPTIC AGENTS, SEDATIVES, MUSCLE RELAXANTS | AMERICAN CYANAMID COMPANY (US) | 1985-06-04 | — | — | US | disclosed |
| EP-0129847-A2 | Aryl and heteroaryl[7-(aryl and heteroaryl)-pyrazolo-[1,5-a]-pyrimidin-3-yl]methanones | AMERICAN CYANAMID COMPANY (US) | 1985-01-02 | — | — | EP | disclosed |