Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 4/20 | 0.64 |
| ▸ | DRD3 | P35462 | 3/20 | 0.64 |
| ▸ | HTR1A | P08908 | 3/20 | 0.58 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | HTR1B | P28222 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4623601 | 0.81 | DRD2 (0.57) | DRD2DRD3HTR1ACYP19A1 | |
| Hydrochloric Acid SCHEMBL5628955 | 0.80 | DRD2 (0.56) | DRD2DRD3HTR1ACYP19A1 | |
| SCHEMBL1950916 | 0.80 | MCHR1 (0.50) | HTR1ACYP19A1SIGMAR1HTR2A | |
| Hydrochloric Acid SCHEMBL4622640 | 0.78 | DRD2 (0.63) | DRD2DRD3CYP19A1SIGMAR1 | |
| SCHEMBL9139949 | 0.78 | HTR1A (0.53) | DRD3HTR1ACYP19A1MTNR1AMTNR1B | |
| SCHEMBL599314 | 0.77 | CYP19A1 (0.54) | HTR1ACYP19A1MTNR1AMTNR1BSIGMAR1 | |
| SCHEMBL7254904 | 0.76 | MCHR1 (0.66) | — | |
| SCHEMBL10616682 | 0.75 | GBA1 (0.52) | DRD2DRD3HTR1ACYP19A1MTNR1A | |
| SCHEMBL9628932 | 0.74 | ADRA2A (0.55) | DRD2DRD3HTR1A | |
| SCHEMBL13688294 | 0.74 | HTR1A (0.61) | DRD2DRD3HTR1AHTR2AHTR2C |
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-2023131638-A1 | 2,3-DIHYDROBENZO [B][1, 4]DIOXIN-2-YLMETHYL)PIPERAZIN-1-YL DERIVATES FOR THE TREATMENT OF SLEEP APNEA | BAYER AKTIENGESELLSCHAFT (DE) | 2023-07-13 | — | — | WO | disclosed |