Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K1 | Q92918 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 10/20 | 0.48 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.48 |
| ▸ | ATR | Q13535 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.44 |
| ▸ | USP2 | O75604 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | AXL | P30530 | 2/20 | 0.41 |
| ▸ | MERTK | Q12866 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.41 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21592815 | 0.82 | MAP3K11 (0.57) | MAP4K1CLK4AXLABL1DCLK1 | |
| SCHEMBL21592484 | 0.82 | MAP4K1 (0.61) | MAP4K1MAPK1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21592476 | 0.79 | MAP4K1 (0.62) | MAP4K1AXLMERTKABL1FLT3 | |
| SCHEMBL21592449 | 0.79 | MAPK1 (0.64) | MAP4K1MAPK1SYK | |
| SCHEMBL28506213 | 0.76 | MAPK1 (0.50) | MAPK1DYRK1A | |
| SCHEMBL21592435 | 0.76 | MAP4K1 (0.77) | MAP4K1MAPK1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21592754 | 0.75 | MAP4K1 (0.68) | MAP4K1MAPK1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL21592734 | 0.73 | MAP4K1 (0.57) | MAP4K1MAPK1ATR | |
| SCHEMBL21592473 | 0.73 | MAP4K1 (0.57) | MAP4K1MAPK1ATR | |
| SCHEMBL21592737 | 0.73 | MAP4K1 (0.57) | MAP4K1MAPK1ATR |
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-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |