Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.39 |
| ▸ | PDE4A | P27815 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 2/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL24344995 | 0.81 | LRRK2 (0.35) | HCRTR1HCRTR2LRRK2PDE4AHPGD | |
| SCHEMBL29534763 | 0.81 | LRRK2 (0.35) | HCRTR1HCRTR2LRRK2PDE4AHPGD | |
| SCHEMBL24344934 | 0.81 | LRRK2 (0.35) | HCRTR1HCRTR2LRRK2PDE4AHPGD | |
| SCHEMBL4074890 | 0.79 | ALDH1A1 (0.44) | HPGDSMN1; SMN2ALDH1A1DRD1 | |
| SCHEMBL25344006 | 0.76 | LRRK2 (0.43) | LRRK2PDE4ACHRNB4CHRNA3KCNH2 | |
| SCHEMBL25347949 | 0.76 | LRRK2 (0.43) | LRRK2PDE4ACHRNB4CHRNA3PDE4B | |
| SCHEMBL29534561 | 0.75 | MEN1 (0.42) | LRRK2SMN1; SMN2ALDH1A1 | |
| SCHEMBL24344461 | 0.75 | MEN1 (0.42) | LRRK2SMN1; SMN2ALDH1A1 | |
| SCHEMBL4076975 | 0.74 | ATP4A (0.38) | HPGDSMN1; SMN2ALDH1A1DRD1 | |
| SCHEMBL26670647 | 0.72 | HCRTR1 (0.41) | HCRTR1HCRTR2ALDH1A1 |
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-2022076975-A1 | 5- AND 6-AZAINDOLE COMPOUNDS FOR INHIBITION OF BCR-ABL TYROSINE KINASES | ENLIVEN THERAPEUTICS, INC. (US) | 2022-04-14 | — | — | WO | disclosed |