Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6323594 | 0.95 | TSHR (0.51) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6324086 | 0.95 | HDAC1 (0.52) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6333112 | 0.95 | TSHR (0.51) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6323211 | 0.93 | CYP1A2 (0.60) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6332451 | 0.92 | CYP1A2 (0.48) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6326417 | 0.91 | TSHR (0.60) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6334127 | 0.91 | CYP1A2 (0.52) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6327897 | 0.91 | HDAC1 (0.51) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6328068 | 0.91 | HDAC1 (0.51) | TSHRSMN1; SMN2CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6323563 | 0.89 | TSHR (0.57) | TSHRSMN1; SMN2LMNAALDH1A1HPGD |
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 |