Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 8/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 8/20 | 0.50 |
| ▸ | MAP2 | P11137 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | GFER | P55789 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8553338 | 0.82 | ALDH1A1 (0.47) | MAP2HSD17B10KDM4EALDH1A1NPC1 | |
| SCHEMBL8548287 | 0.80 | GABRA1 (0.46) | MAP2HSD17B10KDM4EALDH1A1NPC1 | |
| SCHEMBL8550354 | 0.78 | ALDH1A1 (0.47) | MTNR1AMTNR1BHSD17B10USP2KDM4E | |
| SCHEMBL8798575 | 0.73 | PADI4 (0.55) | KDM4EALDH1A1HPGDSMN1; SMN2MAPT | |
| SCHEMBL5766861 | 0.70 | KDM4E (0.46) | MTNR1AMTNR1BHSD17B10USP2MAPK1 | |
| SCHEMBL9242484 | 0.70 | ALDH1A1 (0.53) | MTNR1AMTNR1BHSD17B10KDM4EALDH1A1 | |
| SCHEMBL15057905 | 0.70 | PTGS2 (0.60) | MTNR1AMTNR1BHSD17B10KDM4EALDH1A1 | |
| SCHEMBL9242831 | 0.69 | ALDH1A1 (0.53) | MTNR1AMTNR1BHSD17B10USP2MAPK1 | |
| SCHEMBL11152136 | 0.69 | MEN1 (0.46) | HSD17B10KDM4EALDH1A1NPC1HPGD | |
| SCHEMBL7532767 | 0.68 | KDM4E (0.68) | MTNR1AMTNR1BMAP2HSD17B10KDM4E |
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-0863898-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019077-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-05-29 | — | — | WO | disclosed |