Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 10/20 | 0.45 |
| ▸ | PKLR | P30613 | 5/20 | 0.45 |
| ▸ | RORC | P51449 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL16004015 | 0.93 | RORC (0.42) | PKMPKLRRORCLMNAL3MBTL1 | |
| SCHEMBL16004326 | 0.89 | PKM (0.46) | PKMPKLRRORCKMT2AMEN1 | |
| SCHEMBL16004327 | 0.89 | PKM (0.51) | PKMPKLRRORCKMT2AMEN1 | |
| SCHEMBL16004229 | 0.88 | PKM (0.46) | PKMPKLRRORCKMT2ALMNA | |
| SCHEMBL16004164 | 0.86 | RORC (0.44) | PKMPKLRRORCKMT2AMEN1 | |
| SCHEMBL16004330 | 0.85 | PKM (0.46) | PKMPKLRRORCKMT2AMEN1 | |
| SCHEMBL16004099 | 0.84 | PKM (0.52) | PKMPKLRRORCKMT2AMEN1 | |
| SCHEMBL16004017 | 0.84 | PKM (0.44) | PKMPKLRRORCLMNAL3MBTL1 | |
| SCHEMBL16004335 | 0.83 | MEN1 (0.43) | PKMKMT2AMEN1ALDH1A1SMN1; SMN2 | |
| SCHEMBL16004019 | 0.83 | PKM (0.44) | PKMPKLRRORCKMT2AMEN1 |
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 |