Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CASP6 | P55212 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.35 |
| ▸ | NT5E | P21589 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17178116 | 0.97 | TDP1 (0.43) | ALDH1A1TDP1HSD17B10TSHRPARP1 | |
| SCHEMBL17174090 | 0.96 | PARP1 (0.46) | ALDH1A1TDP1HSD17B10TSHRPARP1 | |
| SCHEMBL17174096 | 0.93 | PARP1 (0.48) | ALDH1A1TDP1HSD17B10TSHRPARP1 | |
| SCHEMBL17146614 | 0.88 | KDM4E (0.53) | ALDH1A1TDP1TSHRPARP1CYP2C9 | |
| SCHEMBL17174089 | 0.86 | ALDH1A1 (0.43) | ALDH1A1TDP1HSD17B10TSHRPARP1 | |
| SCHEMBL17174097 | 0.85 | PARP1 (0.43) | ALDH1A1TDP1TSHRPARP1HDAC6 | |
| SCHEMBL17174112 | 0.84 | ALDH1A1 (0.41) | ALDH1A1TDP1HSD17B10TSHRPARP1 | |
| SCHEMBL17174094 | 0.84 | PARP1 (0.48) | ALDH1A1TDP1TSHRPARP1HDAC6 | |
| SCHEMBL17174066 | 0.82 | KDM4E (0.57) | ALDH1A1TDP1HSD17B10TSHRCYP2C9 | |
| SCHEMBL17146607 | 0.82 | KDM4E (0.57) | ALDH1A1TDP1HSD17B10TSHRCYP2C9 |
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 |