Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.41 |
| ▸ | JMJD6 | Q6NYC1 | 4/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 2/20 | 0.37 |
| ▸ | KDM5C | P41229 | 2/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.37 |
| ▸ | KDM5A | P29375 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | WNT1 | P04628 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21257697 | 0.93 | PIK3CA (0.46) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257581 | 0.87 | KDM4C (0.47) | PIK3CAKDM5BKDM5CKDM4CKDM5A | |
| SCHEMBL21257814 | 0.85 | KDM5B (0.48) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257802 | 0.85 | JMJD6 (0.43) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257696 | 0.79 | KDM4C (0.55) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257752 | 0.78 | KDM4C (0.54) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257600 | 0.76 | KDM5C (0.46) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257715 | 0.75 | KDM5B (0.47) | PIK3CAJMJD6KDM5BKDM5CKDM4C | |
| SCHEMBL21257664 | 0.73 | KDM4C (0.48) | JMJD6KDM5BKDM5CKDM4CKDM5A | |
| SCHEMBL21257720 | 0.73 | KDM4C (0.50) | JMJD6KDM5BKDM5CKDM4CKDM5A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019154261-A1 | PYRIDINE DERIVATIVE RELATED TO KMD5 PATHWAY | 南京明德新药研发股份有限公司 | 2019-08-15 | — | — | WO | disclosed |