Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 9/20 | 0.49 |
| ▸ | PKLR | P30613 | 5/20 | 0.49 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16004099 | 0.90 | PKM (0.52) | PKMPKLRPOLBLMNATSHR | |
| SCHEMBL16004336 | 0.89 | PKM (0.52) | PKMPKLRPOLBLMNATSHR | |
| SCHEMBL16004228 | 0.87 | PKM (0.52) | PKMPKLRLMNAKDM4EGAA | |
| SCHEMBL16004227 | 0.86 | PKM (0.43) | PKMPKLRLMNARORCMAPT | |
| SCHEMBL16004164 | 0.85 | RORC (0.44) | PKMPKLRPOLBLMNATSHR | |
| SCHEMBL16004020 | 0.81 | PKM (0.40) | PKMPKLRPOLBLMNAMAPT | |
| SCHEMBL16004338 | 0.81 | LMNA (0.39) | PKMPKLRLMNAMAPK1RORC | |
| SCHEMBL16004262 | 0.79 | L3MBTL1 (0.45) | POLBLMNATSHRMAPK1RORC | |
| SCHEMBL16004230 | 0.78 | PKM (0.46) | PKMPKLRLMNAMAPK1RORC | |
| SCHEMBL16004229 | 0.78 | PKM (0.46) | PKMPKLRLMNATSHRMAPK1 |
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-2014133414-A2 | HETEROCYCLIC TGR5 BILE ACID RECEPTOR AGONISTS, PHARMACEUTICAL COMPOSITION, METHODS FOR THE PRODUCTION AND USE THEREOF | АЛЛА ХЕМ ЛЛС (US) | 2014-09-04 | — | — | WO | disclosed |