Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29824 | 0.85 | AR (0.32) | — | |
| SCHEMBL15562802 | 0.76 | FFAR1 (0.35) | — | |
| SCHEMBL1083195 | 0.74 | ALDH1A1 (0.37) | NOTUMAGTR2ALDH1A1SMN1; SMN2L3MBTL1 | |
| Hydrochloric Acid SCHEMBL25261707 | 0.72 | ALDH1A1 (0.36) | NOTUMAGTR2ALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL14845189 | 0.72 | HSD17B10 (0.31) | — | |
| SCHEMBL9396845 | 0.63 | SLC6A2 (0.53) | NOTUMALDH1A1SIGMAR1 | |
| SCHEMBL20140971 | 0.63 | SLC6A2 (0.53) | NOTUMALDH1A1SIGMAR1 | |
| Hydrochloric Acid SCHEMBL20140710 | 0.62 | SLC6A2 (0.51) | NOTUMALDH1A1SIGMAR1 | |
| SCHEMBL3525123 | 0.62 | ALDH1A1 (0.36) | NOTUMAGTR2ALDH1A1SMN1; SMN2 | |
| SCHEMBL30867774 | 0.60 | GRM6 (0.48) | AGTR2ALDH1A1SIGMAR1 |
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-2588480-A2 | 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF& xA; | SANOFI (FR) | 2013-05-08 | — | — | EP | disclosed |
| WO-2011161537-A2 | 3,4-DIHYDROPYRROLO[1,2-A]PYRAZINE-2,8(1H)-DICARBOXAMIDE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2011-12-29 | — | — | WO | disclosed |