Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | KDM1A | O60341 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.35 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.35 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | KISS1R | Q969F8 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL291583 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM1AKDM4EATM | |
| SCHEMBL291582 | 1.00 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM1AKDM4EATM | |
| SCHEMBL1194994 | 0.83 | KDM4E (0.43) | ALDH1A1TDP1KDM1AKDM4EATM | |
| SCHEMBL28538742 | 0.83 | KDM4E (0.43) | ALDH1A1TDP1KDM1AKDM4EATM | |
| SCHEMBL2171776 | 0.82 | KDM1A (0.42) | ALDH1A1TDP1KDM1AKDM4EATM | |
| SCHEMBL15978312 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TDP1KDM1ACA2CACNA2D1 | |
| SCHEMBL11511816 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM1ACA2CACNA2D1 | |
| SCHEMBL11511817 | 0.80 | ALDH1A1 (0.48) | ALDH1A1TDP1KDM1ACA2CACNA2D1 | |
| SCHEMBL15482735 | 0.78 | KDM4E (0.43) | KDM1AKDM4EATM | |
| 3-Methylbutanoic Acid SCHEMBL7036541 | 0.78 | KDM1A (0.46) | ALDH1A1TDP1KDM1AKDM4EATM |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102056897-A | Sulfonamide compound and application thereof | ASAHI KASEI PHARMA CORP | 2011-05-11 | — | — | CN | disclosed |
| CN-101781206-A | Preparation method of vinyl isobutyl acetate | WEIFANG DACHENG SALT & CHEMICA | 2010-07-21 | — | — | CN | disclosed |
| CN-1146588-C | Compositions suitable for use in electrochemical cells | BASF | 2004-04-21 | — | — | CN | disclosed |
| CN-1390365-A | Wet-on-wet coating method for producing composite bodies that are suitable for use in lithium ion batteries | BASF AG (DE) | 2003-01-08 | — | — | CN | disclosed |
| CN-1355940-A | Composite material suitable for use as a separator for a chemical battery | BASF AG (DE) | 2002-06-26 | — | — | CN | disclosed |
| CN-1308642-A | Compositions suitable for use in electrochemical cells | BASF AG (DE) | 2001-08-15 | — | — | CN | disclosed |
| CN-1257612-A | Method for producing molded articles for lithium ion batteries | BASF AG (DE) | 2000-06-21 | — | — | CN | disclosed |