Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.34 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.34 |
| ▸ | NEK1 | Q96PY6 | 1/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 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 | |
|---|---|---|---|---|
| SCHEMBL403401 | 0.86 | CYP2C19 (0.41) | MAOAMAOBHTR2AHTR2CHTR2B | |
| SCHEMBL17624447 | 0.85 | CCR1 (0.35) | HTR2AHTR2CHTR2BIKBKBRAF1 | |
| SCHEMBL256752 | 0.74 | HTR2A (0.47) | HTR2AHTR2CHTR2BKDM4E | |
| SCHEMBL15290670 | 0.73 | CYP2C19 (0.35) | MAOAMAOBKDM4ECYP2C19ADRA2A | |
| SCHEMBL795349 | 0.72 | NOS3 (0.44) | HTR2AHTR2CHTR2BKDM4EGRIN1 | |
| SCHEMBL795850 | 0.72 | GRM4 (0.40) | HTR2AHTR2CHTR2BKDM4EDRD1 | |
| SCHEMBL8271971 | 0.72 | MAOA (0.40) | MAOAMAOBHTR2CCYP2C19DRD2 | |
| SCHEMBL22993421 | 0.72 | ALDH1A1 (0.36) | MAOAMAOBHTR2AHTR2CHTR2B | |
| SCHEMBL14295646 | 0.72 | C5AR1 (0.46) | KDM4EDRD2DRD4DRD3 | |
| SCHEMBL23198626 | 0.71 | CHRM4 (0.41) | MAOAMAOBKDM4ECYP2C19 |
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-2021032148-A1 | AMINOPYRAZINE COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2021-02-25 | — | — | WO | disclosed |