Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 14/20 | 0.39 |
| ▸ | DRD3 | P35462 | 8/20 | 0.39 |
| ▸ | DRD4 | P21917 | 4/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 6/20 | 0.38 |
| ▸ | HTR1A | P08908 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23739437 | 0.90 | DRD2 (0.42) | ADAMTS5DRD2DRD3DRD4OPRM1 | |
| SCHEMBL23739663 | 0.87 | MAPT (0.48) | LMNAMAPTKDM4EALDH1A1HTT | |
| SCHEMBL23739841 | 0.79 | MAPT (0.53) | LMNAMAPTALDH1A1HTTNPSR1 | |
| SCHEMBL23739743 | 0.78 | HTR2A (0.33) | LMNAMAPTALDH1A1HTTNPSR1 | |
| SCHEMBL23739539 | 0.77 | DRD2 (0.43) | DRD2DRD3DRD4HTR2AHTR1A | |
| SCHEMBL23739525 | 0.77 | DRD2 (0.52) | DRD2DRD3DRD4HTR2AHTR1A | |
| SCHEMBL23739650 | 0.77 | DRD2 (0.40) | DRD2DRD3DRD4HTR2AHTR1A | |
| SCHEMBL23739567 | 0.77 | DRD2 (0.55) | DRD2DRD3DRD4HTR2AHTR1A | |
| SCHEMBL23739489 | 0.76 | NPC1 (0.43) | LMNAMAPTKDM4EALDH1A1HTT | |
| SCHEMBL23739454 | 0.75 | DRD2 (0.52) | DRD2DRD3DRD4HTR2AHTR1A |
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 |