Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 7/20 | 0.47 |
| ▸ | CHRM3 | P20309 | 7/20 | 0.47 |
| ▸ | DRD4 | P21917 | 10/20 | 0.46 |
| ▸ | DRD2 | P14416 | 9/20 | 0.46 |
| ▸ | DRD3 | P35462 | 9/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.43 |
| ▸ | HTR3B | O95264 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29913676 | 0.90 | KDM4E (0.45) | CHRM2CHRM3DRD4DRD2DRD3 | |
| SCHEMBL29913506 | 0.88 | HTR3E (0.39) | CHRM2CHRM3HTR3EHTR3BHTR1A | |
| SCHEMBL29913679 | 0.87 | CHRM2 (0.50) | CHRM2CHRM3DRD4DRD2DRD3 | |
| SCHEMBL29913618 | 0.82 | CHRM2 (0.47) | CHRM2CHRM3DRD4DRD2DRD3 | |
| SCHEMBL29913488 | 0.82 | CCR3 (0.45) | DRD4DRD2DRD3ACHEHTR3E | |
| SCHEMBL30686535 | 0.80 | ALDH1A1 (0.35) | DRD4OPRM1OPRK1OPRL1 | |
| SCHEMBL29913422 | 0.79 | CHRM3 (0.43) | CHRM2CHRM3DRD4DRD2DRD3 | |
| SCHEMBL29913632 | 0.79 | CHRM3 (0.47) | CHRM2CHRM3DRD4DRD2DRD3 | |
| SCHEMBL29913599 | 0.79 | CHRM3 (0.47) | CHRM2CHRM3DRD4DRD2DRD3 | |
| SCHEMBL27228273 | 0.77 | SIGMAR1 (0.53) | DRD4DRD2DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4305029-A1 | NEW 2,3-DIHYDRO-1H-PYRROLO[3,2-B]PYRIDINE DERIVATIVES AS SIGMA LIGANDS | Acondicionamiento Tarrasense (ES) | 2024-01-17 | — | — | EP | disclosed |
| WO-2022189392-A1 | NEW 2,3-DIHYDRO-1H-PYRROLO[3,2-b]PYRIDINE DERIVATIVES AS SIGMA LIGANDS | ACONDICIONAMIENTO TARRASENSE (ES) | 2022-09-15 | — | — | WO | disclosed |