Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 SCHEMBL9692454 | 0.99 | HTT (0.45) | HTTNPC1RAB9AMTNR1ADRD2 | |
| SCHEMBL568215 | 0.90 | DRD2 (0.52) | DRD2HTR1A | |
| Hydrochloric Acid SCHEMBL9692447 | 0.89 | DRD2 (0.51) | DRD2 | |
| SCHEMBL9825383 | 0.84 | MTNR1A (0.45) | HTTNPC1RAB9AMTNR1ADRD2 | |
| Hydrochloric Acid SCHEMBL9825109 | 0.83 | MTNR1A (0.44) | HTTNPC1RAB9AMTNR1ADRD2 | |
| SCHEMBL9692821 | 0.82 | MALT1 (0.42) | MTNR1ADRD2HTR1ATDP1 | |
| Hydrochloric Acid SCHEMBL9692813 | 0.81 | MALT1 (0.42) | MTNR1ADRD2HTR1ATDP1 | |
| SCHEMBL9692630 | 0.80 | HTT (0.46) | HTTNPC1RAB9AMTNR1ADRD2 | |
| SCHEMBL9692374 | 0.80 | HTT (0.48) | HTTNPC1RAB9AMTNR1ADRD2 | |
| SCHEMBL9692643 | 0.80 | HTT (0.46) | HTTNPC1RAB9AMTNR1ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0252005-B1 | HYDROGENATED 1-BENZOOXACYCLOALKYL-PYRIDINE CARBOXYLIC-ACID COMPOUNDS | CIBA-GEIGY AG (CH) | 1991-07-10 | — | — | EP | claimed |