Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIT | P10721 | 1/20 | 0.39 |
| ▸ | METAP2 | P50579 | 2/20 | 0.38 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | TEC | P42680 | 1/20 | 0.35 |
| ▸ | TXK | P42681 | 1/20 | 0.35 |
| ▸ | BLK | P51451 | 1/20 | 0.35 |
| ▸ | BMX | P51813 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | ITK | Q08881 | 1/20 | 0.35 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16337236 | 0.78 | BTK (0.50) | AURKAMAP4K4ERBB2TECTXK | |
| SCHEMBL28320196 | 0.76 | KIT (0.39) | KITMETAP2ENPP2PDPK1AURKA | |
| SCHEMBL23518814 | 0.75 | METAP2 (0.40) | KITMETAP2ENPP2PDPK1AURKA | |
| SCHEMBL28093874 | 0.73 | METAP2 (0.68) | KITMETAP2ENPP2PDPK1AURKA | |
| SCHEMBL22347150 | 0.66 | MAP4K4 (0.49) | KITMETAP2ENPP2PDPK1AURKA | |
| SCHEMBL21479005 | 0.66 | METAP2 (0.50) | METAP2ENPP2PDPK1AURKAMAP4K4 | |
| SCHEMBL12743472 | 0.64 | GRK2 (0.78) | KITAURKAMAP4K4NUDT1TEC | |
| SCHEMBL2008799 | 0.64 | NOS1 (0.53) | AURKAMAP4K4MEN1MAPT | |
| SCHEMBL2011601 | 0.60 | NOS1 (0.53) | METAP2AXL | |
| SCHEMBL6625935 | 0.60 | PTGDR2 (0.45) | PDE3BPDE3AMEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105530932-B | Primary formamide as BTK inhibitor | 艾伯维公司 | 2019-09-27 | — | — | CN | disclosed |