Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.43 |
| ▸ | GPR142 | Q7Z601 | 2/20 | 0.42 |
| ▸ | ME2 | P23368 | 1/20 | 0.39 |
| ▸ | ME1 | P48163 | 1/20 | 0.39 |
| ▸ | ME3 | Q16798 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | GPR183 | P32249 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16004304 | 0.89 | RIPK1 (0.43) | RIPK1GPR142ME2ME1ME3 | |
| SCHEMBL16003979 | 0.89 | RIPK1 (0.41) | RIPK1GPR142ME2ME1ME3 | |
| SCHEMBL16004308 | 0.88 | ABCB1 (0.48) | RIPK1GPR142KMT2AMEN1GFER | |
| SCHEMBL16004134 | 0.85 | ABCB1 (0.48) | RIPK1GPR142KMT2AALDH1A1GAA | |
| SCHEMBL16003977 | 0.81 | MEN1 (0.48) | RIPK1GPR142KMT2AMEN1MAPT | |
| SCHEMBL16003999 | 0.80 | PIK3CA (0.51) | RIPK1GPR142LMNAALDH1A1PKM | |
| SCHEMBL16004305 | 0.79 | RIPK1 (0.46) | RIPK1GPR142ME2ME1ME3 | |
| SCHEMBL16003975 | 0.78 | ABCB1 (0.46) | RIPK1GPR142KMT2AGFERLMNA | |
| SCHEMBL16004248 | 0.78 | ABCB1 (0.50) | RIPK1GPR142KMT2AGFERALDH1A1 | |
| SCHEMBL16003984 | 0.78 | MAPT (0.47) | RIPK1GPR142KMT2ALMNACYP2D6 |
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 |