Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.53 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 5/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.34 |
| ▸ | WNT3A | P56704 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 4/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.32 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.32 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.32 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9432076 | 0.80 | CYP2A6 (0.70) | CYP2A6DYRK1ACA2MRGPRX4CTNNB1 | |
| SCHEMBL6958280 | 0.80 | CYP2A6 (0.56) | CYP2A6DYRK1ACA2MRGPRX4CTNNB1 | |
| SCHEMBL6958287 | 0.80 | CYP2A6 (0.56) | CYP2A6DYRK1ACA2MRGPRX4CTNNB1 | |
| SCHEMBL9111250 | 0.78 | CYP2A6 (0.36) | CYP2A6MRGPRX4HDAC1HDAC8 | |
| SCHEMBL9111666 | 0.75 | CYP2A6 (0.58) | CYP2A6DYRK1ACA2MRGPRX4CTNNB1 | |
| SCHEMBL13177010 | 0.73 | CYP2A6 (0.66) | CYP2A6DYRK1ACA2CTNNB1WNT3A | |
| SCHEMBL9819834 | 0.73 | RELA (0.55) | KCNH2HDAC1HDAC8 | |
| SCHEMBL8735739 | 0.73 | RELA (0.55) | KCNH2HDAC1HDAC8 | |
| SCHEMBL21457945 | 0.70 | CYP2A6 (0.56) | CYP2A6DYRK1ACA2MRGPRX4CTNNB1 | |
| SCHEMBL21457942 | 0.70 | CYP2A6 (0.56) | CYP2A6DYRK1ACA2CTNNB1WNT3A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0670831-A1 | QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1995-09-13 | — | — | EP | disclosed |
| WO-1995009159-A1 | QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1995-04-06 | — | — | WO | disclosed |