Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.44 |
| ▸ | HTR2C | P28335 | 2/20 | 0.44 |
| ▸ | HTR2B | P41595 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8913070 | 0.99 | NQO2 (0.46) | NQO2MTNR1AMTNR1BADRB2HTR1A | |
| SCHEMBL8310519 | 0.95 | NQO2 (0.46) | NQO2MTNR1AMTNR1BADRB2HTR1A | |
| Hydrochloric Acid SCHEMBL8912255 | 0.94 | NQO2 (0.45) | NQO2MTNR1AMTNR1BADRB2HTR1A | |
| SCHEMBL8306212 | 0.83 | HTR2A (0.55) | HTR1ASLC6A4DRD2HTR2A | |
| Hydrochloric Acid SCHEMBL9073679 | 0.83 | HTR2A (0.54) | HTR1ASLC6A4DRD2HTR2A | |
| SCHEMBL9039665 | 0.79 | MTNR1A (0.46) | NQO2MTNR1AMTNR1BADRB2AKR1C3 | |
| SCHEMBL8306860 | 0.79 | HTR1A (0.62) | HTR1ASLC6A4DRD2 | |
| SCHEMBL32669268 | 0.72 | ADRB2 (0.67) | NQO2MTNR1AMTNR1BADRB2HTR2A | |
| SCHEMBL9870723 | 0.72 | DRD2 (0.65) | HTR1ADRD2HTR2AHTR2CHTR2B | |
| SCHEMBL8916558 | 0.70 | DRD2 (0.40) | DRD2HTR2AHTR2CHTR2BSIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0747379-B1 | Derivatives of indole, indazole and benzisoxazole for the treatment of schizophrenia | ADIR (FR) | 1999-08-11 | — | — | EP | disclosed |
| US-5703070-A | PSYCHOLOGICAL DISORDERS | ADIR ET COMPAGNIE (FR) | 1997-12-30 | — | — | US | disclosed |
| EP-0747379-A1 | Derivatives of indole, indazole and benzisoxazole for the treatment of schizophrenia | ADIR ET COMPAGNIE (FR) | 1996-12-11 | — | — | EP | disclosed |