Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | MDM4 | O15151 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29828751 | 1.00 | CACNA1B (0.46) | CACNA1BIDO1MDM4TP53MDM2 | |
| SCHEMBL27128694 | 0.89 | KMT2A (0.48) | IDO1MDM4TP53MDM2 | |
| SCHEMBL27032856 | 0.89 | KMT2A (0.48) | IDO1MDM4TP53MDM2 | |
| SCHEMBL2249386 | 0.86 | PTPN1 (0.49) | IDO1MDM2 | |
| SCHEMBL28741610 | 0.84 | MDM4 (0.46) | CACNA1BMDM4TP53MDM2TNF | |
| SCHEMBL15270998 | 0.84 | MDM2 (0.44) | MDM4TP53MDM2 | |
| SCHEMBL15270996 | 0.84 | MDM2 (0.44) | MDM4TP53MDM2 | |
| SCHEMBL30480132 | 0.83 | CASP3 (0.45) | MDM4TP53MDM2 | |
| SCHEMBL22454530 | 0.82 | MDM4 (0.47) | CACNA1BMDM4TP53MDM2 | |
| SCHEMBL29633732 | 0.82 | MDM4 (0.47) | CACNA1BMDM4TP53MDM2 |
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-4308575-A1 | MACROCYCLES AS CFTR MODULATORS | Idorsia Pharmaceuticals Ltd (CH) | 2024-01-24 | — | — | EP | disclosed |
| WO-2022194399-A1 | MACROCYCLES AS CFTR MODULATORS | IDORSIA PHARMACEUTICALS LTD (CH) | 2022-09-22 | — | — | WO | disclosed |