Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | USP2 | O75604 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6332462 | 0.98 | HDAC1 (0.50) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6326277 | 0.95 | HDAC1 (0.49) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6331344 | 0.94 | HDAC1 (0.54) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6324028 | 0.90 | HPGD (0.59) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6328443 | 0.90 | HDAC1 (0.53) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6326412 | 0.89 | TSHR (0.51) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6327228 | 0.89 | TSHR (0.58) | HPGDCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6333112 | 0.89 | TSHR (0.51) | HDAC1HDAC2HPGDCYP1A2CYP2D6 | |
| SCHEMBL6327904 | 0.88 | HPGD (0.59) | HDAC1HDAC2HDAC8HPGDCYP1A2 | |
| SCHEMBL6328284 | 0.88 | HPGD (0.52) | HPGDCYP1A2CYP2D6CYP2C9CYP2C19 |
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 |