Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | PTGES | O14684 | 3/20 | 0.37 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.36 |
| ▸ | CETP | P11597 | 3/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CASR | P41180 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24326451 | 1.00 | ACHE (0.41) | ACHEPTGESCTSLCTSBCTSS | |
| SCHEMBL15876107 | 0.86 | HSD11B1 (0.37) | PTGESCTSLCTSBCTSSRIPK1 | |
| SCHEMBL24326452 | 0.85 | ACHE (0.44) | ACHEPTGESPTGER2RIPK1TRPM8 | |
| SCHEMBL24326324 | 0.84 | ACHE (0.43) | ACHEPTGESPTGER2RIPK1HDAC6 | |
| SCHEMBL3861529 | 0.82 | CYP1A2 (0.44) | ACHE | |
| SCHEMBL15876209 | 0.80 | SLC7A5 (0.37) | PTGESTRPM8CASR | |
| SCHEMBL16355715 | 0.80 | SLC7A5 (0.37) | PTGESTRPM8CASR | |
| SCHEMBL15876207 | 0.80 | SLC7A5 (0.37) | PTGESTRPM8CASR | |
| SCHEMBL15876197 | 0.77 | CA12 (0.43) | PTGESCTSLCTSBCTSSCASR | |
| SCHEMBL15876003 | 0.76 | DPP4 (0.36) | — |
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-4225447-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076625-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |