Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | NAAA | Q02083 | 1/20 | 0.48 |
| ▸ | GPR142 | Q7Z601 | 8/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | BRS3 | P32247 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MGAT3 | Q09327 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16003977 | 0.94 | MEN1 (0.48) | SIGMAR1NAAAGPR142KMT2ABRS3 | |
| SCHEMBL16004136 | 0.85 | GPR142 (0.46) | SIGMAR1GPR142KMT2ANPC1MAPT | |
| SCHEMBL16004091 | 0.85 | ALDH1A1 (0.48) | SIGMAR1GPR142KMT2ANPC1FAAH | |
| SCHEMBL16004134 | 0.84 | ABCB1 (0.48) | GPR142KMT2AMAPT | |
| SCHEMBL16004248 | 0.83 | ABCB1 (0.50) | GPR142KMT2ANPC1MAPT | |
| SCHEMBL16004253 | 0.82 | SMN1; SMN2 (0.54) | GPR142KMT2ANPC1MAPT | |
| SCHEMBL16004297 | 0.81 | FKBP1A (0.51) | NAAAGPR142NPC1FAAH | |
| SCHEMBL16004308 | 0.81 | ABCB1 (0.48) | GPR142KMT2ANPC1MEN1MAPT | |
| SCHEMBL16004238 | 0.80 | ABCB1 (0.47) | GPR142KMT2ANPC1MAPT | |
| SCHEMBL16004139 | 0.79 | ALDH1A1 (0.53) | GPR142KMT2ANPC1MEN1 |
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 |