Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | RBP4 | P02753 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23006349 | 0.89 | SMN1; SMN2 (0.38) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL28771581 | 0.85 | KDM4E (0.34) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL20584607 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL21726697 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL20584606 | 0.84 | SMN1; SMN2 (0.42) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL22983269 | 0.82 | CTNNB1 (0.43) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL28771585 | 0.82 | RBP4 (0.34) | SMN1; SMN2KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL22982839 | 0.73 | TP53 (0.32) | KMT2AKDM4EGAA | |
| SCHEMBL22982842 | 0.73 | TP53 (0.32) | KMT2AKDM4EGAA | |
| SCHEMBL22983465 | 0.73 | DPP4 (0.33) | KMT2AMEN1KDM4EGAA |
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-4013759-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2022-06-22 | — | — | EP | disclosed |
| WO-2021030556-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2021-02-18 | — | — | WO | disclosed |