Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CHKA | P35790 | 2/20 | 0.49 |
| ▸ | AXL | P30530 | 1/20 | 0.47 |
| ▸ | MERTK | Q12866 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13734911 | 0.81 | DRD4 (0.49) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2CHKA | |
| SCHEMBL14076364 | 0.75 | SIGMAR1 (0.79) | SIGMAR1ALDH1A1KDM4EDRD2HTR1A | |
| SCHEMBL12827369 | 0.72 | CHKA (0.53) | SIGMAR1CHKADRD4DRD3DRD2 | |
| SCHEMBL12126812 | 0.72 | CHKA (0.79) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2CHKA | |
| SCHEMBL13734737 | 0.71 | CD274 (0.48) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2DRD4 | |
| SCHEMBL25255754 | 0.71 | SIGMAR1 (0.63) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2CHKA | |
| SCHEMBL30245819 | 0.71 | SIGMAR1 (0.63) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2CHKA | |
| SCHEMBL30245540 | 0.70 | KDM4E (0.57) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2CHKA | |
| SCHEMBL25248944 | 0.70 | KDM4E (0.57) | SIGMAR1ALDH1A1KDM4ESMN1; SMN2CHKA | |
| SCHEMBL20804357 | 0.69 | SIGMAR1 (0.90) | SIGMAR1ALDH1A1KDM4EDRD2HTR1A |
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-103492389-B | Pyrazolo [4,3-d] pyrimidine as inhibitors of kinases | 原真股份有限公司 | 2016-09-14 | — | — | CN | disclosed |