Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 8/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 5/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5076377 | 0.95 | KMT2A (0.44) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6327152 | 0.95 | KMT2A (0.44) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6326152 | 0.92 | SMN1; SMN2 (0.46) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6327197 | 0.92 | SMN1; SMN2 (0.46) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6328173 | 0.90 | ALDH1A1 (0.42) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6332748 | 0.89 | KMT2A (0.41) | KMT2ACYP1A2CYP2C19CYP2C9TSHR | |
| SCHEMBL6328312 | 0.88 | PARP1 (0.46) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6327952 | 0.86 | KMT2A (0.40) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6333032 | 0.85 | TSHR (0.47) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 | |
| SCHEMBL6322989 | 0.85 | SMN1; SMN2 (0.42) | KMT2ACYP1A2CYP2D6CYP2C19CYP2C9 |
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 |