Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.48 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | RAB9A | P51151 | 6/20 | 0.47 |
| ▸ | HTT | P42858 | 4/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 6/20 | 0.43 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL14715638 | 0.80 | ADORA2A (0.46) | NPC1RAB9AKDM4EALDH1A1MAPT | |
| SCHEMBL5490382 | 0.78 | LCK (0.66) | TAS1R3TAS1R1TAS1R2BRAFLCK | |
| SCHEMBL14715522 | 0.77 | NPC1 (0.53) | NPC1RAB9AHTTALDH1A1MAPT | |
| SCHEMBL14715543 | 0.77 | LCK (0.49) | HTTKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL14715491 | 0.74 | MAPT (0.47) | NPC1RAB9AALDH1A1MAPTTP53 | |
| SCHEMBL14715517 | 0.74 | POLB (0.58) | NPC1RAB9AALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL14715559 | 0.72 | POLB (0.54) | KDM4EALDH1A1TP53L3MBTL1CYP2C9 | |
| SCHEMBL14715462 | 0.72 | ALDH1A1 (0.58) | NPC1KDM4EALDH1A1MAPTTP53 | |
| SCHEMBL14715473 | 0.72 | ADORA2A (0.45) | HTTKDM4EALDH1A1MAPTNPSR1 | |
| SCHEMBL14715533 | 0.72 | ALDH1A1 (0.58) | NPC1RAB9AKDM4EALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1836174-B2 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC (US) | 2019-10-02 | — | — | EP | disclosed |
| EP-1836174-B1 | ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS | AMGEN INC (US) | 2013-02-27 | — | — | EP | disclosed |