Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CD38 | P28907 | 1/20 | 0.36 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.36 |
| ▸ | BDKRB2 | P30411 | 1/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.35 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16646852 | 0.85 | KDM4E (0.44) | KDM4ETSHRHTTNPSR1IDO1 | |
| SCHEMBL17194923 | 0.80 | HTT (0.36) | KDM4ETSHRHTTNPSR1IDO1 | |
| SCHEMBL26259995 | 0.78 | TBXAS1 (0.44) | KDM4EIDO1CD38BDKRB2DYRK1A | |
| SCHEMBL6218537 | 0.77 | ALDH1A1 (0.43) | KDM4ETSHRHCRTR1HCRTR2 | |
| SCHEMBL1685064 | 0.76 | PIK3CD (0.46) | IDO1HCRTR1HCRTR2DYRK1B | |
| SCHEMBL5509075 | 0.74 | PLK1 (0.39) | KDM4ECD38IMPDH2HCRTR1HCRTR2 | |
| SCHEMBL28019355 | 0.74 | CYP2A6 (0.41) | KDM4ETSHRHTTNPSR1IDO1 | |
| SCHEMBL26260003 | 0.73 | IDO1 (0.45) | KDM4ETSHRHTTIDO1BDKRB2 | |
| Hydrochloric Acid SCHEMBL6218930 | 0.73 | MEN1 (0.41) | IDO1IMPDH2HCRTR1HCRTR2GRM5 | |
| SCHEMBL28080111 | 0.71 | KDM4E (0.49) | KDM4EHTTNPSR1DYRK1A |
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-2023180345-A1 | TRICYCLIC PHTHALAZINES AND DERIVATIVES AS SOS1 INHIBITORS | JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) | 2023-09-28 | — | — | WO | disclosed |