Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN5A | Q14524 | 1/20 | 0.67 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.67 |
| ▸ | MAOB | P27338 | 1/20 | 0.65 |
| ▸ | ATM | Q13315 | 2/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8861847 | 0.90 | SIGMAR1 (0.62) | SCN5ASCN9AMAOBATMMEN1 | |
| SCHEMBL11636814 | 0.84 | MAOB (0.51) | SCN5ASCN9AMAOBATMMEN1 | |
| Hydrochloric Acid SCHEMBL4468236 | 0.83 | MAOB (0.66) | SCN5ASCN9AMAOBATMMEN1 | |
| SCHEMBL2844904 | 0.83 | SCN5A (0.76) | SCN5ASCN9AMAOBATMMEN1 | |
| SCHEMBL11634902 | 0.82 | OPRD1 (0.57) | SCN5ASCN9AMAOBMEN1KMT2A | |
| SCHEMBL18118443 | 0.81 | SCN5A (0.62) | SCN5ASCN9AMAOBATMMEN1 | |
| SCHEMBL17892045 | 0.80 | SCN5A (0.61) | SCN5ASCN9AMAOBATMMEN1 | |
| SCHEMBL18118445 | 0.80 | SCN5A (0.60) | SCN5ASCN9AMAOBATMMEN1 | |
| SCHEMBL890239 | 0.80 | CHRM2 (0.58) | MEN1KMT2AALDH1A1KCNH2 | |
| SCHEMBL2628425 | 0.80 | CHRM2 (0.58) | MEN1KMT2AALDH1A1KCNH2 |
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-0730582-A1 | ISOXAZOLE AND PYRAZOLE DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LTD. (GB) | 1996-09-11 | — | — | EP | disclosed |
| WO-1995014672-A1 | ISOXAZOLE AND PYRAZOLE DERIVATIVES AS DOPAMINE RECEPTOR SUBTYPE LIGANDS | MERCK SHARP & DOHME LIMITED (GB) | 1995-06-01 | — | — | WO | disclosed |