Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | GRIA4 | P48058 | 2/20 | 0.38 |
| ▸ | GRIA2 | P42262 | 3/20 | 0.37 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 6/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.34 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13113858 | 1.00 | ALDH1A1 (0.42) | ALDH1A1MAPTHTTKMT2ANPC1 | |
| SCHEMBL13565136 | 0.88 | CRHR1 (0.44) | GRIA4GRIA2CRHR1NPY5RGBA1 | |
| SCHEMBL17090375 | 0.88 | CRHR1 (0.44) | GRIA4GRIA2CRHR1NPY5RGBA1 | |
| SCHEMBL13564733 | 0.87 | ALDH1A1 (0.40) | ALDH1A1MAPTHTTKMT2ANPC1 | |
| SCHEMBL11941022 | 0.86 | GRIA2 (0.44) | GRIA4GRIA2CRHR1NPY5R | |
| SCHEMBL13565872 | 0.86 | CRHR1 (0.41) | ALDH1A1GRIA4GRIA2CRHR1NPY5R | |
| SCHEMBL13439168 | 0.86 | GRIA2 (0.44) | GRIA4GRIA2CRHR1NPY5R | |
| SCHEMBL13565446 | 0.86 | GRIA2 (0.44) | GRIA4GRIA2CRHR1NPY5R | |
| SCHEMBL13564948 | 0.84 | RAB9A (0.40) | ALDH1A1MAPTHTTKMT2ANPC1 | |
| SCHEMBL17090527 | 0.83 | EPHX1 (0.42) | ALDH1A1MAPTKMT2ALMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9139518-B2 | Amine derivative having NPY Y5 receptor antagonistic activity | SHIONOGI & CO., LTD. (JP) | 2015-09-22 | — | — | US | disclosed |