Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9825350 | 0.88 | DRD2 (0.45) | MALT1DRD2HTR2ADRD3SIGMAR1 | |
| SCHEMBL9825463 | 0.82 | MTNR1A (0.41) | MALT1DRD2HTR2ADRD3SIGMAR1 | |
| Hydrochloric Acid SCHEMBL9825461 | 0.81 | MTNR1A (0.41) | MALT1DRD2HTR2ADRD3SIGMAR1 | |
| SCHEMBL9690345 | 0.79 | ALDH1A1 (0.56) | DRD2HTR2AHTR1A | |
| Hydrochloric Acid SCHEMBL9690397 | 0.78 | ALDH1A1 (0.55) | DRD2HTR2AHTR1ALMNA | |
| SCHEMBL9824929 | 0.78 | KCNH2 (0.49) | CYP3A4CYP2D6CYP1A2BCHEMAOB | |
| SCHEMBL9824923 | 0.77 | MALT1 (0.42) | MALT1DRD2HTR2ADRD3SIGMAR1 | |
| Hydrochloric Acid SCHEMBL9824811 | 0.76 | MALT1 (0.41) | MALT1DRD2HTR2ADRD3SIGMAR1 | |
| SCHEMBL9825234 | 0.76 | ADRA2A (0.55) | DRD2MTNR1A | |
| SCHEMBL9692821 | 0.76 | MALT1 (0.42) | MALT1DRD2HTR2ADRD3SIGMAR1 |
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 2 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 |