Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.36 |
| ▸ | SCD | O00767 | 1/20 | 0.35 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.35 |
| ▸ | PRKCI | P41743 | 1/20 | 0.35 |
| ▸ | TYK2 | P29597 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL12446185 | 0.84 | NPC1 (0.43) | ALDH1A1NPC1RAB9AL3MBTL1KDM4E | |
| SCHEMBL7941942 | 0.77 | SORT1 (0.41) | NPC1RAB9APRKCITSHRBACE1 | |
| SCHEMBL12445675 | 0.77 | BACE1 (0.49) | BACE1GRM4 | |
| SCHEMBL12446237 | 0.77 | BACE1 (0.47) | NPC1RAB9AKDM4EPRKCIHPGD | |
| SCHEMBL12445674 | 0.76 | BACE1 (0.47) | PRKCIBACE1GRM4 | |
| SCHEMBL7933492 | 0.75 | BACE1 (0.51) | MCL1SCDSCD5PRKCIBACE1 | |
| SCHEMBL12445871 | 0.74 | BACE1 (0.47) | BACE1GRM4 | |
| SCHEMBL12445846 | 0.74 | GRM4 (0.38) | NPC1RAB9APRKCISMN1; SMN2BACE1 | |
| SCHEMBL12446239 | 0.72 | PRKCI (0.40) | ALDH1A1PRKCITYK2TSHRBACE1 | |
| SCHEMBL7943969 | 0.70 | PRKCI (0.47) | PRKCITYK2BACE1GRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2360155-A1 | 2-AMINOPYRIDIN-4-ONE AND 2-AMINOPYRIDINE DERIVATIVE BOTH HAVING BACE1-INHIBITING ACTIVITY | Shionogi & Co., Ltd. (JP) | 2011-08-24 | — | — | EP | disclosed |