Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.40 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD1 | P21728 | 2/20 | 0.35 |
| ▸ | DRD5 | P21918 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL25302605 | 0.86 | MAOA (0.40) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL14945586 | 0.82 | ADRA2A (0.49) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL28811771 | 0.79 | MAOA (0.40) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL24040089 | 0.79 | MAOA (0.40) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL29843380 | 0.79 | MAOA (0.40) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL29557955 | 0.79 | MAOA (0.40) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL28587395 | 0.78 | GABRA1 (0.40) | MAOAMAOBADRA2AADRA2BADRA2C | |
| SCHEMBL30068796 | 0.76 | NOTUM (0.46) | — | |
| SCHEMBL25255482 | 0.76 | NOTUM (0.46) | — | |
| SCHEMBL28596005 | 0.74 | MAOA (0.36) | MAOAMAOBADRA2AADRA2BADRA2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023131122-A1 | FUSED RING-SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2023-07-13 | — | — | WO | disclosed |
| CN-113166139-A | Pyrrolo [2,3-b ] pyridines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-07-23 | — | — | CN | disclosed |