Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.39 |
| ▸ | CTPS1 | P17812 | 6/20 | 0.34 |
| ▸ | CTPS2 | Q9NRF8 | 1/20 | 0.33 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.32 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | GCK | P35557 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21077014 | 0.86 | CTPS1 (0.42) | ADRB3CTPS1NPC1RAB9AMEN1 | |
| SCHEMBL21077047 | 0.82 | CTPS1 (0.52) | ADRB3CTPS1CTPS2FPR2NPC1 | |
| SCHEMBL21044566 | 0.81 | CTPS1 (0.52) | CTPS1CTPS2 | |
| SCHEMBL21077175 | 0.78 | CTPS1 (0.44) | CTPS1CTPS2FPR2AAK1NPC1 | |
| SCHEMBL21077114 | 0.78 | CTPS1 (0.55) | CTPS1CTPS2 | |
| SCHEMBL21077246 | 0.78 | CTPS1 (0.54) | CTPS1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL21077199 | 0.78 | CTPS1 (0.53) | ADRB3CTPS1CTPS2NPC1RAB9A | |
| SCHEMBL21077048 | 0.76 | CTPS1 (0.43) | ADRB3CTPS1 | |
| SCHEMBL21077107 | 0.76 | CTPS1 (0.54) | ADRB3CTPS1 | |
| SCHEMBL21077015 | 0.76 | CTPS1 (0.41) | ADRB3CTPS1GCK |
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-3492454-A1 | COMPOUNDS | Step Pharma S.A.S. (FR) | 2019-06-05 | — | — | EP | disclosed |