Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL4716289 | 0.79 | NPC1 (0.68) | ALDH1A1MAPTNPC1RAB9AKDM4E | |
| SCHEMBL14821628 | 0.78 | ALDH1A1 (0.69) | ALDH1A1MAPTPOLBGAAL3MBTL1 | |
| SCHEMBL4718330 | 0.76 | PTGER1 (0.49) | MAPTL3MBTL1NPC1LMNAKMT2A | |
| SCHEMBL25078721 | 0.75 | ALDH1A1 (0.56) | ALDH1A1GAARAB9AKDM4EMAPK1 | |
| SCHEMBL28567094 | 0.75 | ALDH1A1 (0.54) | ALDH1A1MAPTPOLBNPC1RAB9A | |
| SCHEMBL1803916 | 0.74 | NOTUM (0.52) | ALDH1A1MAPTPOLBL3MBTL1NPC1 | |
| SCHEMBL408713 | 0.72 | NOTUM (0.43) | NOTUMADORA3HSP90AA1 | |
| SCHEMBL1804767 | 0.72 | NOTUM (0.43) | ALDH1A1L3MBTL1KDM4EALOX15SMN1; SMN2 | |
| SCHEMBL16578388 | 0.72 | AADAT (0.44) | ALDH1A1MAPTPOLBGAAL3MBTL1 | |
| SCHEMBL16578372 | 0.71 | NPC1 (0.40) | ALDH1A1MAPTPOLBGAAL3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2003076443-A9 | SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY | BANYU PHARMA CO LTD (JP) | 2005-01-20 | — | — | WO | disclosed |
| EP-1483266-A1 | SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076443-A1 | SPIRO COMPOUNDS WITH NPY ANTAGONISTIC ACTIVITY | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2003-09-18 | — | — | WO | disclosed |