Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | APEX1 | P27695 | 2/20 | 0.46 |
| ▸ | CASP6 | P55212 | 1/20 | 0.46 |
| ▸ | PDE7A | Q13946 | 4/20 | 0.44 |
| ▸ | S100A4 | P26447 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | FGR | P09769 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.42 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.42 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28785447 | 0.85 | TDP1 (0.53) | TSHRMAPK1POLBMAPTAPEX1 | |
| SCHEMBL11027038 | 0.84 | S100A4 (0.59) | TSHRMAPK1POLBMAPTAPEX1 | |
| SCHEMBL8777833 | 0.82 | POLB (0.66) | TSHRMAPK1POLBMAPTAPEX1 | |
| SCHEMBL11246306 | 0.80 | ALDH1A1 (0.55) | TSHRMAPK1POLBMAPTS100A4 | |
| SCHEMBL11749574 | 0.79 | TSHR (0.60) | TSHRPOLBMAPTAPEX1CASP6 | |
| SCHEMBL10355816 | 0.79 | TSHR (0.60) | TSHRPOLBMAPTAPEX1CASP6 | |
| SCHEMBL11250084 | 0.79 | TSHR (0.60) | TSHRPOLBMAPTAPEX1CASP6 | |
| SCHEMBL28848020 | 0.79 | HSP90AA1 (0.44) | TSHRMAPK1POLBPDE7AS100A4 | |
| SCHEMBL11674411 | 0.78 | S100A4 (0.58) | TSHRMAPK1POLBMAPTAPEX1 | |
| SCHEMBL11668925 | 0.78 | S100A4 (0.58) | TSHRMAPK1POLBMAPTAPEX1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105585875-A | Dication active dye for salt-free dyeing of cotton fabrics and preparation method thereof | NANJING UNIVERSITY OF TECHNOLOGY | 2016-05-18 | — | — | CN | disclosed |