Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6324511 | 0.98 | SMN1; SMN2 (0.45) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL5074272 | 0.96 | SMN1; SMN2 (0.46) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6330588 | 0.96 | HPGD (0.48) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6331242 | 0.94 | HPGD (0.48) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6327897 | 0.93 | HDAC1 (0.51) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6328068 | 0.91 | HDAC1 (0.51) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6332451 | 0.91 | CYP1A2 (0.48) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6328158 | 0.91 | HPGD (0.53) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6332476 | 0.89 | NPSR1 (0.47) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 | |
| SCHEMBL6332801 | 0.89 | HPGD (0.53) | SMN1; SMN2TSHRHPGDCYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6924284-B2 | PARP inhibitors | ICOS CORPORATION (US) | 2005-08-02 | — | — | US | disclosed |