Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8313611 | 0.84 | NPC1 (0.41) | KDM4ESMN1; SMN2NPC1RAB9AGAA | |
| SCHEMBL8311427 | 0.82 | SCN9A (0.35) | POLBKDM4ERAB9AALDH1A1LMNA | |
| SCHEMBL8316296 | 0.82 | CCR1 (0.35) | POLBKDM4ESMN1; SMN2NPC1TP53 | |
| SCHEMBL8875966 | 0.81 | NPY5R (0.34) | POLBKDM4ESMN1; SMN2LMNAHTT | |
| SCHEMBL8316184 | 0.80 | KDM4E (0.37) | POLBKDM4ESMN1; SMN2NPC1TP53 | |
| SCHEMBL8315486 | 0.80 | NPC1 (0.39) | POLBKDM4ESMN1; SMN2NPC1TP53 | |
| SCHEMBL8315309 | 0.79 | ADRA1A (0.38) | POLBKDM4ESMN1; SMN2NPC1TP53 | |
| SCHEMBL8312863 | 0.79 | MAPT (0.39) | KDM4ESMN1; SMN2NPC1TP53RAB9A | |
| SCHEMBL8315585 | 0.79 | ADRA1A (0.40) | POLBKDM4ESMN1; SMN2NPC1TP53 | |
| SCHEMBL8314584 | 0.79 | FABP6 (0.37) | RAB9AMAPTGRM5 |
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-0626954-B1 | BENZOCYCLOHEPTENES, BENZOXEPINES AND BENZOTHIEPINES | MERCK PATENT GMBH (DE) | 1999-03-17 | — | — | EP | disclosed |
| US-5602152-A | POTASSIUM CHANNEL MODULATOR | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1997-02-11 | — | — | US | disclosed |
| WO-1994013658-A2 | BENZOCYCLOHEPTENES, BENZOXEPINES AND BENZOTHIEPINES | MERCK PATENT GMBH (DE) | 1994-06-23 | — | — | WO | disclosed |