Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 9/20 | 0.55 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.41 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.41 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.41 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.39 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 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 | |
|---|---|---|---|---|
| SCHEMBL27936855 | 0.74 | LRRK2 (0.59) | LRRK2PIK3CAPIK3CDHRH4SMG1 | |
| SCHEMBL1269228 | 0.74 | PGR (0.41) | PIK3CAMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL24405984 | 0.72 | EED (0.45) | PIK3CAMAP4K1MAPK8 | |
| SCHEMBL17573363 | 0.71 | LRRK2 (1.00) | LRRK2MAP4K1 | |
| SCHEMBL24406033 | 0.70 | KMT2A (0.43) | MEN1KMT2AKDM4EALDH1A1HPGD | |
| SCHEMBL14094434 | 0.69 | SMN1; SMN2 (0.47) | ALDH1A1 | |
| SCHEMBL24405670 | 0.68 | GAA (0.40) | MEN1TSHRKMT2AKDM4EALDH1A1 | |
| SCHEMBL24406056 | 0.68 | CNR2 (0.40) | ALDH1A1HRH4 | |
| SCHEMBL17430354 | 0.68 | LRRK2 (0.50) | LRRK2PIK3CAMEN1KMT2AKDM4E | |
| SCHEMBL827848 | 0.67 | PIK3CA (0.58) | LRRK2PIK3CAMEN1TSHRKMT2A |
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-3774739-B1 | FUSED CYCLIC UREA DERIVATIVES AS CRHR2 ANTAGONIST | RAQUALIA PHARMA INC (JP) | 2022-05-11 | — | — | EP | disclosed |