Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.42 |
| ▸ | DRD2 | P14416 | 4/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | PDE9A | O76083 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | USP2 | O75604 | 2/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30047448 | 0.81 | DRD2 (0.43) | DRD2HTR1ACRBNMEN1ALDH1A1 | |
| SCHEMBL15311796 | 0.81 | DRD2 (0.43) | DRD2HTR1ACRBNMEN1ALDH1A1 | |
| SCHEMBL26954410 | 0.81 | DRD2 (0.40) | DRD2HTR1ACRBNHCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL23403776 | 0.80 | DRD2 (0.43) | DRD2HTR1ACRBNMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL29974676 | 0.80 | DRD2 (0.43) | DRD2HTR1ACRBNMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL23045207 | 0.80 | DRD2 (0.43) | DRD2HTR1ACRBNMEN1ALDH1A1 | |
| SCHEMBL28241594 | 0.79 | DRD2 (0.49) | DRD2HTR1ACYP2D6DRD3TSHR | |
| SCHEMBL6772080 | 0.77 | ADRB1 (0.49) | DRD2HTR1ACYP2D6DRD3TSHR | |
| SCHEMBL21646391 | 0.77 | DRD2 (0.48) | DRD2HTR1ACYP2D6DRD3TSHR | |
| Hydrochloric Acid SCHEMBL28808104 | 0.76 | DRD2 (0.47) | DRD2HTR1AALDH1A1HPGDMAPK1 |
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-2024133499-A1 | GLYCINE DERIVATIVES WITH P2X4 RECEPTOR-BLOCKING ACTIVITY AS DIAGNOSTICS AND FOR THE TREATMENT OF PAIN, INFLAMMATION, CANCER, AND OTHER P2X4 RECEPTOR-RELATED DISEASES | RHEINISCHE-FRIEDRICH-WILHELMS-UNIVERSITÄT BONN (DE) | 2024-06-27 | — | — | WO | disclosed |