Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 5/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.49 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.49 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | BRAF | P15056 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL15038309 | 0.80 | MKNK1 (0.50) | ADORA2AADORA1SRCBRAFKDR | |
| SCHEMBL15038351 | 0.80 | CLK4 (0.52) | ADORA2AADORA1ADORA2BMAPK14KDR | |
| SCHEMBL26242512 | 0.80 | ADORA2A (0.44) | ADORA2AADORA1ADORA2BADORA3MAPK14 | |
| SCHEMBL15038342 | 0.80 | LMNA (0.40) | ADORA2AADORA1MAPK14SRCBRAF | |
| SCHEMBL15038312 | 0.78 | NPC1 (0.45) | MAPK14ALDH1A1RAB9AKDM4ECYP1A2 | |
| SCHEMBL15038353 | 0.78 | KMT2A (0.45) | ADORA2AADORA1ALDH1A1RAB9AKDM4E | |
| SCHEMBL15038318 | 0.73 | SMO (0.48) | SRCKDRALDH1A1KDM4E | |
| SCHEMBL14959329 | 0.72 | KDM4E (0.56) | ADORA2AADORA1ADORA2BALDH1A1KDM4E | |
| SCHEMBL30617006 | 0.72 | MAPK14 (0.41) | ADORA2AADORA1ADORA2BADORA3MAPK14 | |
| SCHEMBL20075444 | 0.70 | MAPK14 (0.60) | ADORA2AADORA1ADORA2BADORA3MAPK14 |
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-2318389-B1 | PYRIDAZINE DERIVATIVES AS SMO INHIBITORS | NOVARTIS AG (CH) | 2013-06-19 | — | — | EP | disclosed |