Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.43 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL16004274 | 0.90 | RIPK1 (0.46) | KDM4ERIPK1GPR142PIK3CAMEN1 | |
| SCHEMBL16004269 | 0.89 | RIPK1 (0.46) | RIPK1GPR142PIK3CAMEN1KMT2A | |
| SCHEMBL16004249 | 0.87 | RIPK1 (0.41) | RIPK1GPR142PIK3CAMEN1KMT2A | |
| SCHEMBL16004233 | 0.86 | GPR142 (0.47) | RIPK1GPR142PIK3CAKMT2AALDH1A1 | |
| SCHEMBL16004117 | 0.85 | KDM4E (0.43) | KDM4ERIPK1GPR142PIK3CAMEN1 | |
| SCHEMBL16004285 | 0.84 | CREBBP (0.54) | CREBBP | |
| SCHEMBL16004052 | 0.83 | PIK3CA (0.52) | RIPK1PIK3CAALDH1A1HPGDGAA | |
| SCHEMBL16004054 | 0.82 | PIK3CA (0.49) | RIPK1PIK3CAMEN1KMT2ACREBBP | |
| SCHEMBL16004055 | 0.82 | PIK3CA (0.49) | RIPK1GPR142PIK3CAMEN1KMT2A | |
| SCHEMBL16004053 | 0.81 | RIPK1 (0.49) | RIPK1GPR142PIK3CAALDH1A1GAA |
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 |