Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1562973 | 0.92 | KDM4C (0.35) | NPC1RAB9AKDM4C | |
| SCHEMBL1710182 | 0.91 | NPC1 (0.38) | NPC1RAB9AKDM4C | |
| SCHEMBL1710209 | 0.88 | KDM4C (0.33) | NPC1RAB9AKDM4C | |
| SCHEMBL1710278 | 0.82 | NPC1 (0.38) | NPC1RAB9AKDM4CPTPN1 | |
| SCHEMBL1710353 | 0.79 | NPC1 (0.39) | NPC1RAB9AKDM4C | |
| SCHEMBL1710212 | 0.78 | NPC1 (0.36) | NPC1RAB9AKDM4CPTPN1 | |
| SCHEMBL1710180 | 0.78 | NPC1 (0.40) | NPC1RAB9AKDM4CPTPN1 | |
| SCHEMBL1710252 | 0.78 | KDM4C (0.39) | NPC1RAB9AKDM4C | |
| SCHEMBL3125092 | 0.74 | NPC1 (0.36) | NPC1RAB9AKDM4CPTPN1 | |
| SCHEMBL2937355 | 0.73 | NPC1 (0.34) | NPC1RAB9AKDM4CPTPN1 |
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-2344477-A1 | SMALL MOLECULE BRADYKININ B2 RECEPTOR MODULATORS | Jerini AG (DE) | 2011-07-20 | — | — | EP | disclosed |
| WO-2010031589-A1 | SMALL MOLECULE BRADYKININ B2 RECEPTOR MODULATORS | JERINI AG (DE) | 2010-03-25 | — | — | WO | disclosed |