Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.45 |
| ▸ | RELA | Q04206 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17174136 | 0.91 | PARP1 (0.49) | PARP1NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL17174129 | 0.85 | SRC (0.46) | PARP1NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL17174134 | 0.84 | SRC (0.45) | PARP1MAP4K4 | |
| SCHEMBL17174132 | 0.84 | NPC1 (0.58) | PARP1NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL17174143 | 0.82 | SRC (0.43) | PARP1MAP4K4 | |
| SCHEMBL2347376 | 0.78 | NPC1 (0.62) | PARP1NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL17174208 | 0.77 | EGLN1 (0.44) | PARP1NPC1RAB9AKDM4ERELA | |
| Hydrochloric Acid SCHEMBL30398025 | 0.76 | NPC1 (0.61) | PARP1NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL17174108 | 0.76 | FBP1 (0.44) | PARP1RAB9AALDH1A1MAP4K4HPGD | |
| Hydrochloric Acid SCHEMBL30289774 | 0.74 | NPC1 (0.59) | PARP1NPC1RAB9AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-9748593-B2 | Polymer electrolyte composition, and polymer electrolyte membrane, membrane electrode complex and solid polymer-type fuel cell each produced using same | TORAY INDUSTRIES, INC. (JP) | 2017-08-29 | — | — | US | disclosed |
| US-20150295262-A1 | POLYMER ELECTROLYTE COMPOSITION, AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE ELECTRODE COMPLEX AND SOLID POLYMER-TYPE FUEL CELL EACH PRODUCED USING SAME | TORAY INDUSTRIES, INC. (JP) | 2015-10-15 | — | — | US | disclosed |