Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.46 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL21747474 | 0.84 | NPC1 (0.48) | NPC1RAB9APDCD1CD274MEN1 | |
| SCHEMBL21747468 | 0.84 | PDCD1 (0.47) | NPC1RAB9APDCD1CD274MEN1 | |
| SCHEMBL21747444 | 0.81 | S1PR1 (0.50) | NPC1RAB9APDCD1CD274S1PR1 | |
| SCHEMBL21747487 | 0.80 | PDCD1 (0.47) | NPC1RAB9APDCD1CD274MEN1 | |
| SCHEMBL30468251 | 0.78 | HDAC6 (0.47) | NPC1RAB9APDCD1CD274KMT2A | |
| SCHEMBL21747460 | 0.78 | HDAC6 (0.47) | NPC1RAB9APDCD1CD274KMT2A | |
| SCHEMBL21747481 | 0.77 | SIRT1 (0.49) | NPC1RAB9APDCD1CD274MEN1 | |
| SCHEMBL30468304 | 0.76 | GPR119 (0.49) | NPC1RAB9APDCD1CD274S1PR1 | |
| SCHEMBL21747456 | 0.75 | HSD17B10 (0.54) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL29829612 | 0.71 | CD274 (0.68) | NPC1RAB9APDCD1CD274S1PR1 |
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-3613735-A1 | NOVEL SIRT 1 ACTIVATOR AND MEDICINAL USE THEREOF | Pusan National University Industry - University Cooperation Foundation (KR) | 2020-02-26 | — | — | EP | disclosed |