Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.44 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL33271 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL388879 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| Bromide SCHEMBL2812026 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| Water SCHEMBL28087307 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| SCHEMBL19478722 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| SCHEMBL31474386 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| Hydrochloric Acid SCHEMBL8005745 | 0.88 | MAPK1 (0.52) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| SCHEMBL12386148 | 0.88 | ALDH1A1 (0.56) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| Iodide SCHEMBL8208149 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 | |
| Hydrogen Sulfide SCHEMBL28301039 | 0.88 | ALDH1A1 (0.50) | ALDH1A1KDM4ESMN1; SMN2KEAP1MAPK1 |
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-105218688-B | A kind of starch flocculant of polyamine cationic polymer modification and preparation method thereof | 黄河水利职业技术学院 | 2018-04-10 | — | — | CN | disclosed |