Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | CES2 | O00748 | 4/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.44 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.44 |
| ▸ | HNF4A | P41235 | 2/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | GSTA1 | P08263 | 1/20 | 0.41 |
| ▸ | CDC25B | P30305 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.40 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.40 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.40 |
| ▸ | DCLRE1B | Q9H816 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 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 | |
|---|---|---|---|---|
| SCHEMBL11724363 | 0.87 | ALDH1A1 (0.53) | ALDH1A1MAPK1TDP1CES2CES1 | |
| SCHEMBL11719521 | 0.86 | ALDH1A1 (0.48) | ALDH1A1MAPK1TDP1CES2CES1 | |
| SCHEMBL11312027 | 0.83 | GSTA1 (0.53) | ALDH1A1MAPK1TDP1ACMSDHNF4A | |
| SCHEMBL11568765 | 0.77 | ACMSD (0.49) | ALDH1A1MAPK1TDP1ACMSDHNF4A | |
| SCHEMBL11530588 | 0.77 | ACMSD (0.49) | ALDH1A1MAPK1TDP1ACMSDHNF4A | |
| SCHEMBL27889068 | 0.76 | CES2 (0.56) | ALDH1A1CES2CES1ACMSDHNF4A | |
| SCHEMBL11528988 | 0.75 | ALDH1A1 (0.52) | ALDH1A1MAPK1TDP1ACMSDHNF4A | |
| SCHEMBL11527797 | 0.75 | ALDH1A1 (0.52) | ALDH1A1MAPK1TDP1ACMSDHNF4A | |
| SCHEMBL27281349 | 0.74 | CDC25B (0.63) | ALDH1A1TDP1ACMSDHNF4ADHFR | |
| SCHEMBL27998334 | 0.74 | TDP1 (0.65) | ALDH1A1MAPK1TDP1KMOTRIM24 |
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-7888397-B1 | Poly(phenylene)-based anion exchange membrane | SANDIA CORPORATION (US) | 2011-02-15 | — | — | US | disclosed |
| US-7816482-B1 | in hydrogen fuel cells, direct methanol fuel cell, in electrode casting solutions and electrodes, and in sulfur dioxide electrolyzers; tougher, higher temperature capability, lower SO2 crossover rates; sulfonated poly(phenylene) and a tetrahydroxy bis(cyclopentadienone) with a tetra-epoxy crosslinker | SANDIA CORPORATION (US) | 2010-10-19 | — | — | US | disclosed |