Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 5/20 | 0.41 |
| ▸ | BTK | Q06187 | 4/20 | 0.41 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 4/20 | 0.39 |
| ▸ | AXL | P30530 | 6/20 | 0.39 |
| ▸ | EGFR | P00533 | 3/20 | 0.38 |
| ▸ | KDR | P35968 | 3/20 | 0.38 |
| ▸ | NEK2 | P51955 | 2/20 | 0.38 |
| ▸ | PTK6 | Q13882 | 2/20 | 0.38 |
| ▸ | MAP4K5 | Q9Y4K4 | 2/20 | 0.38 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | KRAS | P01116 | 1/20 | 0.38 |
| ▸ | RAF1 | P04049 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ARAF | P10398 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16948748 | 1.00 | ITK (0.41) | ITKBTKPAK1BRAFAXL | |
| SCHEMBL18238690 | 0.92 | AAK1 (0.42) | ITKBTKAXLEGFRKDR | |
| SCHEMBL16949002 | 0.92 | AAK1 (0.42) | ITKBTKAXLEGFRKDR | |
| SCHEMBL18238802 | 0.91 | AXL (0.42) | ITKBTKAXLEGFRKDR | |
| SCHEMBL16949120 | 0.91 | AXL (0.42) | ITKBTKAXLEGFRKDR | |
| SCHEMBL18250476 | 0.91 | AXL (0.39) | ITKBTKAXLEGFRKDR | |
| SCHEMBL16949409 | 0.90 | AXL (0.47) | ITKAXLEGFRKDRNEK2 | |
| SCHEMBL18238648 | 0.90 | AXL (0.47) | ITKAXLEGFRKDRNEK2 | |
| SCHEMBL16949003 | 0.90 | AXL (0.38) | ITKBTKAXLEGFRKDR | |
| SCHEMBL18239059 | 0.90 | AXL (0.38) | ITKBTKAXLEGFRKDR |
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 |
|---|---|---|---|---|---|---|---|
| US-9499551-B2 | Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases | CONFLUENCE LIFE SCIENCES, INC. (US) | 2016-11-22 | — | — | US | disclosed |