Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | P4HA1 | P13674 | 1/20 | 0.36 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.36 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL14023317 | 0.86 | KCNJ1 (0.45) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL2749675 | 0.82 | KCNJ1 (0.45) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL31098145 | 0.82 | KCNJ1 (0.45) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL27536580 | 0.80 | KCNJ1 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL13369515 | 0.80 | KCNJ1 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL14642628 | 0.80 | KCNJ1 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL16213698 | 0.80 | KCNJ1 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL12639886 | 0.80 | KCNJ1 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL30024515 | 0.80 | KCNJ1 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR | |
| SCHEMBL16935001 | 0.78 | HCAR3 (0.44) | KCNJ1KMT2AL3MBTL1GAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016095205-A1 | HETEROARYL OREXIN RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2016-06-23 | — | — | WO | disclosed |