Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.42 |
| ▸ | JAK1 | P23458 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | BMPR1B | O00238 | 1/20 | 0.39 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 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 | |
|---|---|---|---|---|
| SCHEMBL6868095 | 0.83 | KDM4E (0.53) | NPC1RAB9AKDM4EHTTALDH1A1 | |
| SCHEMBL7142283 | 0.80 | ALOX15 (0.43) | NPC1RAB9AKDM4EHTTALDH1A1 | |
| SCHEMBL6868263 | 0.80 | MAPT (0.46) | NPC1RAB9AJAK1ALDH1A1TP53 | |
| SCHEMBL6870443 | 0.79 | LMNA (0.45) | NPC1RAB9AKDM4EALDH1A1HPGD | |
| SCHEMBL6863748 | 0.79 | ADORA2A (0.64) | NPC1RAB9AKDM4EHTTALDH1A1 | |
| SCHEMBL6871320 | 0.79 | SMN1; SMN2 (0.43) | NPC1RAB9AKDM4EHTTALDH1A1 | |
| SCHEMBL6868478 | 0.79 | ADORA2A (0.64) | NPC1RAB9AKDM4EHTTALDH1A1 | |
| SCHEMBL6869047 | 0.79 | ADORA2A (0.40) | NPC1RAB9AKDM4EJAK2ALDH1A1 | |
| SCHEMBL6867146 | 0.79 | ADORA2A (0.62) | KDM4EALDH1A1HPGDADORA2AMAPT | |
| SCHEMBL6867550 | 0.78 | ADORA2A (0.67) | HPGDADORA2A |
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-1347974-B1 | AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |