Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TACR3 | P29371 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SMO | Q99835 | 1/20 | 0.43 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL623163 | 0.84 | ALDH1A1 (0.41) | ALDH1A1HTR2CTSHRMEN1POLB | |
| SCHEMBL624219 | 0.84 | ALDH1A1 (0.42) | ALDH1A1HTR2CTSHRMEN1POLB | |
| SCHEMBL623490 | 0.82 | ALDH1A1 (0.39) | ALDH1A1HTR2CTSHRMEN1POLB | |
| SCHEMBL624238 | 0.82 | L3MBTL1 (0.44) | ALDH1A1HTR2CTSHRMEN1KMT2A | |
| SCHEMBL623132 | 0.72 | PTGDR2 (0.42) | ALDH1A1HTR2CHPGDTLR7KDM4E | |
| SCHEMBL622745 | 0.69 | IRAK4 (0.47) | TLR7 | |
| SCHEMBL623783 | 0.69 | PTGDR2 (0.43) | HTR2CTLR7 | |
| SCHEMBL624123 | 0.69 | PTGDR2 (0.43) | ALDH1A1HTR2CL3MBTL1TLR7SLC6A7 | |
| SCHEMBL2550713 | 0.68 | PDE10A (0.57) | ALDH1A1KMT2AL3MBTL1TLR7HSD17B10 | |
| SCHEMBL17953075 | 0.68 | PTGDR2 (0.54) | HTR2CTLR7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8999974-B2 | Acyl piperazine derivatives as TTX-S blockers | RAQUALIA PHARMA INC. (JP) | 2015-04-07 | — | — | US | disclosed |
| US-8999974-B2 | Acyl piperazine derivatives as TTX-S blockers | RAQUALIA PHARMA INC. (JP) | 2015-04-07 | — | — | US | disclosed |