Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.42 |
| ▸ | CDK14 | O94921 | 1/20 | 0.40 |
| ▸ | CCNY | Q8ND76 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 3/20 | 0.40 |
| ▸ | BTK | Q06187 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | F2R | P25116 | 1/20 | 0.38 |
| ▸ | TXK | P42681 | 1/20 | 0.37 |
| ▸ | ITK | Q08881 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16100490 | 1.00 | MAPT (0.42) | MAPTL3MBTL1HSP90AA1CDK14CCNY | |
| SCHEMBL16102029 | 0.87 | TXK (0.48) | MAPTL3MBTL1BTKRAB9AALOX15 | |
| SCHEMBL16102030 | 0.87 | TXK (0.48) | MAPTL3MBTL1BTKRAB9AALOX15 | |
| SCHEMBL17608793 | 0.83 | MAPT (0.41) | MAPTL3MBTL1CDK14CCNYEGFR | |
| SCHEMBL17608791 | 0.83 | MAPT (0.41) | MAPTL3MBTL1CDK14CCNYEGFR | |
| SCHEMBL31672355 | 0.83 | MAPT (0.41) | MAPTL3MBTL1CDK14CCNYEGFR | |
| SCHEMBL16101856 | 0.82 | HSP90AA1 (0.48) | HSP90AA1RAB9ALMNATP53ALOX15 | |
| SCHEMBL17643350 | 0.79 | BLM (0.49) | HSP90AA1RAB9ALMNATP53ALOX15 | |
| SCHEMBL17800783 | 0.79 | BTK (0.40) | MAPTL3MBTL1CDK14CCNYEGFR | |
| SCHEMBL31672378 | 0.79 | BTK (0.40) | MAPTL3MBTL1CDK14CCNYEGFR |
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-2970121-A1 | COVALENT INHIBITORS OF KRAS G12C | Araxes Pharma LLC (US) | 2016-01-20 | — | — | EP | disclosed |
| WO-2014152588-A1 | COVALENT INHIBITORS OF KRAS G12C | ARAXES PHARMA LLC (US) | 2014-09-25 | — | — | WO | disclosed |