Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 3/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | SELE | P16581 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PTAFR | P25105 | 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 | |
|---|---|---|---|---|
| SCHEMBL3125095 | 0.82 | NPC1 (0.34) | NPC1RAB9AP2RX3KDM4CPDE4B | |
| SCHEMBL1710180 | 0.80 | NPC1 (0.40) | NPC1RAB9AP2RX3KDM4CPDE4B | |
| SCHEMBL1710182 | 0.80 | NPC1 (0.38) | NPC1RAB9AP2RX3KDM4CPDE4B | |
| SCHEMBL1710252 | 0.79 | KDM4C (0.39) | NPC1RAB9AP2RX3KDM4CICAM1 | |
| SCHEMBL1562973 | 0.77 | KDM4C (0.35) | NPC1RAB9AP2RX3KDM4CCCNA2 | |
| SCHEMBL1710342 | 0.74 | NPC1 (0.33) | NPC1RAB9AKDM4CPTPN1 | |
| SCHEMBL1710209 | 0.73 | KDM4C (0.33) | NPC1RAB9AP2RX3KDM4CL3MBTL1 | |
| SCHEMBL1710200 | 0.73 | NPC1 (0.41) | NPC1RAB9AP2RX3KDM4CPDE4B | |
| SCHEMBL1710353 | 0.72 | NPC1 (0.39) | NPC1RAB9AP2RX3KDM4CPDE4B | |
| SCHEMBL1710278 | 0.71 | NPC1 (0.38) | NPC1RAB9AP2RX3KDM4CPDE4B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010031589-A1 | SMALL MOLECULE BRADYKININ B2 RECEPTOR MODULATORS | JERINI AG (DE) | 2010-03-25 | — | — | WO | disclosed |