Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | F10 | P00742 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6057412 | 0.84 | SSTR4 (0.44) | — | |
| SCHEMBL7448822 | 0.84 | SSTR4 (0.44) | — | |
| SCHEMBL7812352 | 0.81 | MEN1 (0.36) | CYP3A4 | |
| SCHEMBL7809845 | 0.79 | NPC1 (0.34) | — | |
| Acetic Acid SCHEMBL1812749 | 0.74 | SLC6A4 (0.46) | SLC6A4SLC6A2HTR2C | |
| SCHEMBL7806051 | 0.73 | ALDH1A1 (0.41) | — | |
| SCHEMBL4661812 | 0.72 | ALDH1A1 (0.41) | — | |
| Oxalic Acid SCHEMBL1760951 | 0.72 | SLC6A2 (0.44) | SLC6A4SLC6A2HTR2C | |
| SCHEMBL4661814 | 0.72 | ALDH1A1 (0.41) | — | |
| SCHEMBL21429712 | 0.72 | CYP3A4 (0.43) | KCNH2CYP3A4MAPTMAPK1 |
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-1119553-A1 | MONOMERIC AND DIMERIC HETEROCYCLES, AND THERAPEUTIC USES THEREOF | GEORGETOWN UNIVERSITY (US) | 2001-08-01 | — | — | EP | disclosed |
| WO-2000020390-A1 | MONOMERIC AND DIMERIC HETEROCYCLES, AND THERAPEUTIC USES THEREOF | GEORGETOWN UNIVERSITY (US) | 2000-04-13 | — | — | WO | disclosed |