Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.43 |
| ▸ | KLF5 | Q13887 | 3/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.43 |
| ▸ | GPR142 | Q7Z601 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NAMPT | P43490 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16004105 | 0.87 | GPR142 (0.55) | GPR142NAMPTKDM4ETSHR | |
| SCHEMBL16003987 | 0.87 | CREBBP (0.44) | NPC1KLF5PAX8GPR142SMN1; SMN2 | |
| SCHEMBL16004314 | 0.83 | GPR142 (0.56) | NPC1GPR142SMN1; SMN2RAB9ANAMPT | |
| SCHEMBL16004104 | 0.82 | GPR142 (0.53) | NPC1GPR142KMT2ARAB9AALDH1A1 | |
| SCHEMBL16004096 | 0.78 | MAPT (0.55) | NPC1GPR142MEN1KMT2ARAB9A | |
| SCHEMBL16004312 | 0.77 | NPC1 (0.46) | NPC1GPR142SMN1; SMN2MEN1KMT2A | |
| SCHEMBL16004157 | 0.77 | GPR142 (0.58) | GPR142NAMPT | |
| SCHEMBL16004297 | 0.77 | FKBP1A (0.51) | NPC1GPR142SMN1; SMN2RAB9AALDH1A1 | |
| SCHEMBL16004094 | 0.74 | GPR142 (0.64) | GPR142 | |
| SCHEMBL16004093 | 0.74 | GPR142 (0.54) | NPC1GPR142RAB9AALDH1A1POLB |
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 |