Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 5/20 | 0.34 |
| ▸ | HTR7 | P34969 | 5/20 | 0.34 |
| ▸ | BRD4 | O60885 | 4/20 | 0.34 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.33 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 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 | |
|---|---|---|---|---|
| SCHEMBL24309437 | 1.00 | MAP4K3 (0.35) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL24309771 | 0.87 | PTK2 (0.35) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL29567013 | 0.87 | PTK2 (0.35) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL29567027 | 0.86 | BRD4 (0.35) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL24309451 | 0.86 | BRD4 (0.35) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL24309993 | 0.85 | BRD4 (0.36) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL29566770 | 0.85 | BRD4 (0.36) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL24309436 | 0.85 | HTR1A (0.36) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL24310440 | 0.82 | HTR1A (0.34) | MAP4K3MAP4K1HTR1AHTR7BRD4 | |
| SCHEMBL29566951 | 0.82 | HTR1A (0.34) | MAP4K3MAP4K1HTR1AHTR7BRD4 |
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-4225748-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |