Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6332518 | 0.98 | HDAC1 (0.51) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6326111 | 0.96 | TSHR (0.51) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6326412 | 0.94 | TSHR (0.51) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6332801 | 0.93 | HPGD (0.53) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6328068 | 0.92 | HDAC1 (0.51) | HDAC1HDAC2TSHRLMNASMN1; SMN2 | |
| SCHEMBL6328500 | 0.92 | GAA (0.54) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6328158 | 0.91 | HPGD (0.53) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6328554 | 0.91 | HDAC1 (0.53) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6325170 | 0.91 | LMNA (0.51) | HDAC1HDAC2HDAC8TSHRLMNA | |
| SCHEMBL6334127 | 0.91 | CYP1A2 (0.52) | HDAC1HDAC2HDAC8TSHRLMNA |
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 |