Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.45 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CHKA | P35790 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL21747444 | 0.85 | S1PR1 (0.50) | NPC1RAB9AS1PR1S1PR3PDCD1 | |
| SCHEMBL21747491 | 0.84 | NPC1 (0.49) | NPC1RAB9AKDM4ETSHRS1PR1 | |
| SCHEMBL21747473 | 0.82 | NPC1 (0.44) | NPC1RAB9AIDO1TDO2IDO2 | |
| SCHEMBL30468304 | 0.82 | GPR119 (0.49) | NPC1RAB9AIDO1TDO2IDO2 | |
| SCHEMBL21747471 | 0.78 | HDAC1 (0.50) | KDM4EMAPTHSD17B10TSHRS1PR1 | |
| SCHEMBL21747448 | 0.76 | HSD17B10 (0.49) | NPC1RAB9AKDM4ETP53MAPT | |
| Hydrochloric Acid SCHEMBL21747452 | 0.75 | HSD17B10 (0.49) | NPC1RAB9AKDM4ETP53MAPT | |
| SCHEMBL21747442 | 0.74 | SIRT1 (0.52) | HSD17B10S1PR1S1PR3LMNA | |
| SCHEMBL29829612 | 0.73 | CD274 (0.68) | NPC1RAB9AS1PR1S1PR3PDCD1 | |
| SCHEMBL31193700 | 0.72 | RAB9A (0.73) | NPC1RAB9AKDM4ETP53MAPT |
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-3613735-B1 | NOVEL SIRT 1 ACTIVATOR AND MEDICINAL USE THEREOF | NAT UNIV PUSAN IND UNIV COOP FOUND (KR) | 2023-04-12 | — | — | EP | disclosed |
| EP-3613735-A1 | NOVEL SIRT 1 ACTIVATOR AND MEDICINAL USE THEREOF | Pusan National University Industry - University Cooperation Foundation (KR) | 2020-02-26 | — | — | EP | disclosed |