Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.51 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.49 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.49 |
| ▸ | SCN1A | P35498 | 1/20 | 0.49 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.49 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.49 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
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 SCHEMBL9825725 | 0.99 | DRD2 (0.53) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL9824689 | 0.90 | MTNR1A (0.46) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL567418 | 0.84 | DRD2 (0.53) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| Hydrochloric Acid SCHEMBL9690277 | 0.83 | DRD2 (0.53) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL9825435 | 0.82 | SIGMAR1 (0.47) | DRD2MTNR1A | |
| SCHEMBL9825208 | 0.81 | DRD2 (0.53) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| Hydrochloric Acid SCHEMBL9825052 | 0.81 | SIGMAR1 (0.47) | DRD2MTNR1A | |
| Hydrochloric Acid SCHEMBL9825333 | 0.80 | DRD2 (0.53) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL567307 | 0.77 | ADRA2A (0.60) | DRD2ADRA2AADRA2BADRA2CADRA1D | |
| SCHEMBL9824923 | 0.76 | MALT1 (0.42) | DRD2MTNR1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0252005-B1 | HYDROGENATED 1-BENZOOXACYCLOALKYL-PYRIDINE CARBOXYLIC-ACID COMPOUNDS | CIBA-GEIGY AG (CH) | 1991-07-10 | — | — | EP | claimed |
| EP-0252005-A1 | Hydrogenated 1-benzooxacycloalkyl-pyridine carboxylic-acid compounds | CIBA-GEIGY AG (CH) | 1988-01-07 | — | — | EP | claimed |
| EP-0252005-B1 | HYDROGENATED 1-BENZOOXACYCLOALKYL-PYRIDINE CARBOXYLIC-ACID COMPOUNDS | CIBA-GEIGY AG (CH) | 1991-07-10 | — | — | EP | disclosed |
| EP-0252005-A1 | Hydrogenated 1-benzooxacycloalkyl-pyridine carboxylic-acid compounds | CIBA-GEIGY AG (CH) | 1988-01-07 | — | — | EP | disclosed |