Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | RHEB | Q15382 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 4/20 | 0.33 |
| ▸ | DRD2 | P14416 | 2/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23148027 | 0.86 | GRIN1 (0.44) | NPC1RAB9AKDM4ERHEBGAA | |
| SCHEMBL23147759 | 0.80 | KDM4E (0.50) | NPC1RAB9AKDM4EPOLBGAA | |
| SCHEMBL29813016 | 0.80 | KDM4E (0.50) | NPC1RAB9AKDM4EPOLBGAA | |
| SCHEMBL18183354 | 0.79 | NPC1 (0.56) | NPC1RAB9AKDM4ERHEBMAP2K1 | |
| SCHEMBL11457867 | 0.78 | NPC1 (0.41) | NPC1RAB9AKDM4ERHEBMAP2K1 | |
| SCHEMBL29063172 | 0.77 | SLC9A1 (0.41) | KDM4ERHEBMAP2K1BCAT1HTR1A | |
| SCHEMBL24037986 | 0.75 | MAOA (0.40) | NPC1RAB9AKDM4EMAOAMAOB | |
| SCHEMBL15506636 | 0.72 | GRIN1 (0.45) | KDM4ERHEBGAA | |
| SCHEMBL23148152 | 0.72 | SMYD3 (0.39) | NPC1RAB9AKDM4EPOLBDRD2 | |
| SCHEMBL29813126 | 0.72 | SMYD3 (0.39) | NPC1RAB9AKDM4EPOLBDRD2 |
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-2892880-B1 | INDOLE CARBOXAMIDE DERIVATIVES AND USES THEREOF | NOVARTIS AG (CH) | 2017-11-22 | — | — | EP | disclosed |