Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29757581 | 0.75 | NPC1 (0.36) | NPC1RAB9APTPN1KDM4C | |
| SCHEMBL21594074 | 0.75 | NPC1 (0.36) | NPC1RAB9APTPN1KDM4C | |
| SCHEMBL23388043 | 0.74 | NPC1 (0.42) | NPC1RAB9AKDM4CTXNRD1 | |
| SCHEMBL29749517 | 0.74 | NPC1 (0.42) | NPC1RAB9AKDM4CTXNRD1 | |
| SCHEMBL29749639 | 0.72 | NPC1 (0.50) | NPC1RAB9AKDM4C | |
| SCHEMBL28796337 | 0.72 | NPC1 (0.50) | NPC1RAB9AKDM4C | |
| SCHEMBL28782014 | 0.71 | SLC6A3 (0.34) | PTPN1KDM4C | |
| SCHEMBL15349909 | 0.71 | F2RL3 (0.35) | NPC1RAB9AKDM4C | |
| SCHEMBL5891959 | 0.71 | POLB (0.38) | — | |
| SCHEMBL2649805 | 0.70 | KDM4C (0.34) | PTPN1KDM4C |
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 |
|---|---|---|---|---|---|---|---|
| CN-114667286-A | Triazatricycles for the treatment of autoimmune diseases | 豪夫迈·罗氏有限公司 | 2022-06-24 | — | — | CN | disclosed |