Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 3/20 | 0.31 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.31 |
| ▸ | PTPRC | P08575 | 3/20 | 0.31 |
| ▸ | PTPN13 | Q12923 | 2/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18639837 | 1.00 | NPC1 (0.33) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18666828 | 1.00 | NPC1 (0.33) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18639867 | 1.00 | NPC1 (0.33) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18639870 | 0.92 | NPC1 (0.33) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18639831 | 0.92 | NPC1 (0.33) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18639825 | 0.92 | NPC1 (0.33) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18639835 | 0.90 | NPC1 (0.32) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18666581 | 0.90 | NPC1 (0.32) | NPC1RAB9AGAAALDH1A1MEN1 | |
| SCHEMBL18639839 | 0.88 | KDM4E (0.39) | ALDH1A1MEN1KMT2AKDM4EALOX15 | |
| SCHEMBL18639836 | 0.88 | KDM4E (0.39) | ALDH1A1MEN1KMT2AKDM4EALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017046036-A1 | COMPOUNDS FOR THE MODULATION OF RIP2 KINASE ACTIVITY | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-03-23 | — | — | WO | disclosed |
| WO-2017046036-A1 | COMPOUNDS FOR THE MODULATION OF RIP2 KINASE ACTIVITY | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2017-03-23 | — | — | WO | disclosed |