Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 3/20 | 0.41 |
| ▸ | IL2 | P60568 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | ACACB | O00763 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | PIP5K1C | O60331 | 2/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 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 | |
|---|---|---|---|---|
| SCHEMBL31055513 | 1.00 | ITK (0.41) | ITKIL2CRBNHDAC4KDR | |
| SCHEMBL24671350 | 0.90 | KDR (0.46) | ITKIL2KDRMGLLPIP5K1C | |
| SCHEMBL30066409 | 0.89 | KDR (0.45) | ITKIL2KDRPARP1MGLL | |
| SCHEMBL24671193 | 0.89 | KDR (0.45) | ITKIL2KDRPARP1MGLL | |
| SCHEMBL30066263 | 0.88 | SMYD3 (0.42) | ITKIL2KDRMEN1KMT2A | |
| SCHEMBL12028513 | 0.84 | ITK (0.44) | ITKCRBNHDAC4KDRACACB | |
| SCHEMBL24671438 | 0.83 | ITK (0.43) | ITKIL2KDRMEN1KMT2A | |
| SCHEMBL24671801 | 0.83 | ITK (0.44) | ITKIL2KMT2APIP5K1C | |
| SCHEMBL30066419 | 0.83 | ITK (0.44) | ITKIL2KMT2APIP5K1C | |
| SCHEMBL24671679 | 0.83 | ITK (0.44) | ITKIL2KDRPIP5K1C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022235715-A1 | COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE | NURIX THERAPEUTICS, INC. (US) | 2022-11-10 | — | — | WO | disclosed |