Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | VNN1 | O95497 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24257684 | 1.00 | NPC1 (0.43) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| Nitrous Acid SCHEMBL29248926 | 0.97 | NPC1 (0.41) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| SCHEMBL29248955 | 0.91 | PPARG (0.40) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| SCHEMBL29248922 | 0.91 | NPC1 (0.39) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| SCHEMBL30546865 | 0.90 | MAOB (0.43) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| SCHEMBL24257621 | 0.88 | MCL1 (0.44) | MCL1MEN1KMT2ADHODH | |
| SCHEMBL30453213 | 0.88 | MCL1 (0.44) | MCL1MEN1KMT2ADHODH | |
| Nitrous Acid SCHEMBL29248892 | 0.88 | MAOB (0.41) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| SCHEMBL24257704 | 0.85 | PPARG (0.39) | NPC1RAB9AKDM4EAKR1C3AKR1C2 | |
| SCHEMBL30453029 | 0.85 | PPARG (0.39) | NPC1RAB9AKDM4EAKR1C3AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116670131-A | PHD inhibitor compounds, compositions, and methods of use | 阿克比治疗有限公司 | 2023-08-29 | — | — | CN | disclosed |
| EP-4196466-A1 | PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | Akebia Therapeutics Inc. (US) | 2023-06-21 | — | — | EP | disclosed |