Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10492715 | 0.84 | CASP1 (0.41) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL15919027 | 0.82 | ALOX15 (0.46) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL111964 | 0.81 | CASP1 (0.43) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL5610781 | 0.78 | TDP1 (0.39) | TDP1CYP3A4TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL5550929 | 0.78 | TDP1 (0.56) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL27961257 | 0.78 | ESR1 (0.42) | TDP1ALOX15CYP3A4CA1ALDH1A1 | |
| SCHEMBL22897735 | 0.77 | ALDH1A1 (0.44) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL3847726 | 0.76 | TRPA1 (0.56) | TDP1ALOX15CYP3A4TP53THRB | |
| SCHEMBL9169236 | 0.75 | TRPA1 (0.61) | TDP1ALOX15TP53SMN1; SMN2ALDH1A1 | |
| SCHEMBL28693586 | 0.75 | SRC (0.41) | TDP1SMN1; SMN2ALDH1A1SLC6A2TRPA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108598533-A | Cyclization cross-linked polyimide proton exchange membrane based on cumarin and preparation method thereof | 同济大学 | 2018-09-28 | — | — | CN | claimed |
| CN-112399988-A | Composition for shielding electromagnetic radiation | 科德宝两合公司 | 2021-02-23 | — | — | CN | disclosed |
| CN-108598533-A | Cyclization cross-linked polyimide proton exchange membrane based on cumarin and preparation method thereof | 同济大学 | 2018-09-28 | — | — | CN | disclosed |