Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP1 | P11387 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11100996 | 0.85 | APP (0.47) | TOP1GAASMN1; SMN2RAB9AMEN1 | |
| SCHEMBL8908078 | 0.83 | CA1 (0.41) | TOP1GAASMN1; SMN2MEN1KMT2A | |
| SCHEMBL30491272 | 0.80 | TOP1 (0.52) | TOP1MGAMGAASIMGAM2 | |
| SCHEMBL15660441 | 0.78 | MAPT (0.49) | TOP1RAB9ANPC1MEN1KMT2A | |
| SCHEMBL77640 | 0.77 | CA9 (0.35) | SMN1; SMN2RAB9ANPC1CA1CA2 | |
| SCHEMBL15623366 | 0.76 | SMN1; SMN2 (0.41) | TOP1SMN1; SMN2RAB9ANPC1MEN1 | |
| SCHEMBL196440 | 0.74 | MGAM (0.55) | TOP1MGAMGAASIMGAM2 | |
| SCHEMBL1587900 | 0.73 | APP (0.42) | GAASMN1; SMN2RAB9ANPC1CA1 | |
| SCHEMBL9494313 | 0.73 | SMN1; SMN2 (0.40) | MGAMGAASIMGAM2SMN1; SMN2 | |
| SCHEMBL7198230 | 0.73 | PDE4B (0.39) | GAASMN1; SMN2RAB9ANPC1MEN1 |
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-0796250-A1 | PYRIDAZINONES AS ENDOTHELIN-RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1997-09-24 | — | — | EP | disclosed |
| CN-1156146-A | Endothelins receptor antagonist | MERCK PATENT GMBH (DE) | 1997-08-06 | — | — | CN | disclosed |
| WO-1997013758-A1 | PYRIDAZINONES AS ENDOTHELIN-RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-04-17 | — | — | WO | disclosed |