Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.33 |
| ▸ | WEE1 | P30291 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 1/20 | 0.33 |
| ▸ | DDO | Q99489 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CSF1R | P07333 | 2/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.32 |
| ▸ | CCND1 | P24385 | 1/20 | 0.32 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.32 |
| ▸ | CAMK2G | Q13555 | 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 | |
|---|---|---|---|---|
| SCHEMBL16814348 | 0.82 | MDM2 (0.39) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16814487 | 0.80 | NQO2 (0.38) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16814275 | 0.79 | NQO2 (0.38) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16795035 | 0.79 | NQO2 (0.42) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16795016 | 0.77 | PARP1 (0.39) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16795057 | 0.77 | MAPK1 (0.47) | PARP1CHEK1WEE1KDM4EALDH1A1 | |
| SCHEMBL16814244 | 0.75 | NQO2 (0.36) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16794896 | 0.75 | NPSR1 (0.38) | NQO2PADI4PARP1CHEK1WEE1 | |
| SCHEMBL16814364 | 0.75 | SERPINE1 (0.49) | CSF1RPOLBCDK4CCND1CAMK2B | |
| SCHEMBL16814627 | 0.74 | PTGS2 (0.46) | PADI4PARP1CHEK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015088564-A1 | P2X4 RECEPTOR MODULATING COMPOUNDS | SUNOVION PHARMACEUTICALS INC. (US) | 2015-06-18 | — | — | WO | disclosed |
| WO-2015088564-A1 | P2X4 RECEPTOR MODULATING COMPOUNDS | SUNOVION PHARMACEUTICALS INC. (US) | 2015-06-18 | — | — | WO | disclosed |