Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CASP1 | P29466 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GPR142 | Q7Z601 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.37 |
| ▸ | NAAA | Q02083 | 2/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 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 | |
|---|---|---|---|---|
| SCHEMBL16004244 | 0.89 | GPR142 (0.37) | KDM4EALOX15CASP1HSD17B10LMNA | |
| SCHEMBL16004290 | 0.87 | CREBBP (0.47) | GPR142 | |
| SCHEMBL16004236 | 0.85 | KDM4E (0.43) | KDM4ESMN1; SMN2KMT2AGPR142ALDH1A1 | |
| SCHEMBL16004286 | 0.85 | GPR142 (0.41) | SMN1; SMN2MGLLGPR142ALDH1A1NPSR1 | |
| SCHEMBL16004233 | 0.81 | GPR142 (0.47) | LMNASMN1; SMN2KMT2AGPR142ALDH1A1 | |
| SCHEMBL16004421 | 0.79 | GPR142 (0.43) | KDM4EHSD17B10LMNASMN1; SMN2KMT2A | |
| SCHEMBL16003966 | 0.77 | MEN1 (0.36) | KDM4ELMNAHTTMGLLKMT2A | |
| SCHEMBL16003971 | 0.77 | MAPT (0.35) | KDM4ELMNAHTTMGLLKMT2A | |
| SCHEMBL16003967 | 0.77 | LMNA (0.40) | KDM4ELMNAHTTMGLLKMT2A | |
| SCHEMBL16003968 | 0.77 | ALDH1A1 (0.42) | KDM4ELMNAHTTMGLLKMT2A |
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 |