Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16003982 | 0.88 | ALDH1A1 (0.45) | HTTKDM4EPOLBALDH1A1CYP1A2 | |
| SCHEMBL16004141 | 0.79 | HTT (0.48) | LMNAHTTSMN1; SMN2KDM4EPOLB | |
| SCHEMBL16004247 | 0.79 | HPGD (0.51) | LMNASMN1; SMN2POLBALDH1A1RIPK1 | |
| SCHEMBL16003980 | 0.78 | FKBP1A (0.53) | SMN1; SMN2KDM4EPOLBALDH1A1CYP1A2 | |
| SCHEMBL16004106 | 0.78 | GPR142 (0.51) | HTTSMN1; SMN2ALDH1A1RIPK1CREBBP | |
| SCHEMBL16004298 | 0.76 | ALDH1A1 (0.49) | LMNAHTTSMN1; SMN2KDM4EPOLB | |
| SCHEMBL16004303 | 0.76 | HPGD (0.49) | LMNASMN1; SMN2POLBRIPK1MAPT | |
| SCHEMBL16004096 | 0.75 | MAPT (0.55) | POLBRIPK1CREBBPTP53MAPT | |
| SCHEMBL16003985 | 0.74 | ATM (0.43) | HTTKDM4EALDH1A1RIPK1TP53 | |
| SCHEMBL16003988 | 0.74 | PIK3CA (0.46) | LMNASMN1; SMN2ALDH1A1RIPK1MAPT |
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 |