Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 4/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.44 |
| ▸ | HTR2A | P28223 | 3/20 | 0.44 |
| ▸ | HTR6 | P50406 | 2/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23739905 | 0.91 | DRD2 (0.45) | HTR1ADRD2HTR2AHTR6HTR7 | |
| SCHEMBL23739600 | 0.91 | KDM4E (0.40) | DRD2KDM4EDRD4ADRA1DADRA1A | |
| SCHEMBL23739920 | 0.91 | HTR1A (0.42) | HTR1ADRD2HTR2AHTR6HTR7 | |
| SCHEMBL23739779 | 0.89 | ADRA1D (0.39) | HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL23739575 | 0.89 | HTR1A (0.39) | HTR1ADRD2HTR2ADRD3ALDH1A1 | |
| SCHEMBL23739670 | 0.89 | DRD2 (0.42) | HTR1ADRD2HTR2AHTR6HTR7 | |
| SCHEMBL23739641 | 0.88 | DRD2 (0.48) | HTR1ADRD2HTR2AHTR6HTR7 | |
| SCHEMBL23739535 | 0.88 | DRD2 (0.42) | HTR1ADRD2HTR2AHTR6HTR7 | |
| SCHEMBL23739669 | 0.87 | DRD2 (0.37) | HTR1ADRD2HTR2AHTR6HTR7 | |
| SCHEMBL23739716 | 0.87 | KCNH2 (0.43) | HTR1ADRD2HTR2AHTR7DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3862348-A1 | ISOINDOLINE COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2021-08-11 | — | — | EP | disclosed |