Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 3/20 | 0.43 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ME2 | P23368 | 1/20 | 0.37 |
| ▸ | ME1 | P48163 | 1/20 | 0.37 |
| ▸ | ME3 | Q16798 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | USP9X | Q93008 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16004305 | 0.91 | RIPK1 (0.46) | RIPK1GPR142L3MBTL1ME2ME1 | |
| SCHEMBL16003975 | 0.90 | ABCB1 (0.46) | RIPK1GPR142KMT2AGFERRAB9A | |
| SCHEMBL16004306 | 0.89 | RIPK1 (0.43) | RIPK1GPR142ME2ME1ME3 | |
| SCHEMBL16003979 | 0.85 | RIPK1 (0.41) | RIPK1GPR142TSHRME2ME1 | |
| SCHEMBL16004134 | 0.84 | ABCB1 (0.48) | RIPK1GPR142KMT2AALDH1A1ABCB1 | |
| SCHEMBL16003981 | 0.80 | PIK3CA (0.44) | RIPK1GPR142KMT2A | |
| SCHEMBL16003977 | 0.79 | MEN1 (0.48) | RIPK1GPR142KMT2A | |
| SCHEMBL16004308 | 0.79 | ABCB1 (0.48) | RIPK1GPR142L3MBTL1KMT2AGFER | |
| SCHEMBL16003983 | 0.78 | GAA (0.43) | RIPK1KMT2ACYP2C9CYP2C19RAB9A | |
| SCHEMBL16004248 | 0.77 | ABCB1 (0.50) | RIPK1GPR142L3MBTL1KMT2AGFER |
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 |