Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.37 |
| ▸ | HTR7 | P34969 | 6/20 | 0.37 |
| ▸ | SLC8A1 | P32418 | 1/20 | 0.35 |
| ▸ | MAP4K1 | Q92918 | 3/20 | 0.35 |
| ▸ | MMP3 | P08254 | 1/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK1 | P06493 | 1/20 | 0.34 |
| ▸ | CDK4 | P11802 | 1/20 | 0.34 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.34 |
| ▸ | CCND1 | P24385 | 1/20 | 0.34 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CCND3 | P30281 | 1/20 | 0.34 |
| ▸ | CDK7 | P50613 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | CCNH | P51946 | 1/20 | 0.34 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.34 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.34 |
| ▸ | MAP4K3 | Q8IVH8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309454 | 1.00 | HTR1A (0.37) | HTR1AHTR7SLC8A1MAP4K1MMP3 | |
| SCHEMBL24310081 | 0.91 | BRD4 (0.35) | HTR1AHTR7SLC8A1MMP3CCNT1 | |
| SCHEMBL29567168 | 0.91 | BRD4 (0.35) | HTR1AHTR7SLC8A1MMP3CCNT1 | |
| SCHEMBL24309455 | 0.90 | BRD4 (0.37) | HTR1AHTR7SLC8A1MAP4K1CCNT1 | |
| SCHEMBL24309452 | 0.89 | HTR1A (0.39) | HTR1AHTR7SLC8A1MMP3CDK4 | |
| SCHEMBL29567027 | 0.88 | BRD4 (0.35) | HTR1AHTR7SLC8A1MAP4K1MMP3 | |
| SCHEMBL24309451 | 0.88 | BRD4 (0.35) | HTR1AHTR7SLC8A1MAP4K1MMP3 | |
| SCHEMBL24309960 | 0.88 | PTK2 (0.32) | HTR1AHTR7SLC8A1MAP4K1BRD4 | |
| SCHEMBL24309964 | 0.87 | TNK2 (0.34) | SLC8A1MAP4K1CCNT1CDK1CDK4 | |
| SCHEMBL24309772 | 0.82 | HTR1A (0.35) | HTR1AHTR7SLC8A1CCNT1CDK1 |
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 |