Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.44 |
| ▸ | TYMS | P04818 | 3/20 | 0.43 |
| ▸ | DAO | P14920 | 2/20 | 0.43 |
| ▸ | LCK | P06239 | 1/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.40 |
| ▸ | PIM2 | Q9P1W9 | 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 | |
|---|---|---|---|---|
| SCHEMBL1721110 | 0.77 | ADRA2A (0.50) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| SCHEMBL10229086 | 0.76 | PARP1 (0.44) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| SCHEMBL13901568 | 0.76 | PARP1 (0.47) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| Iodide SCHEMBL1720068 | 0.75 | PARP1 (0.46) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| SCHEMBL9843379 | 0.75 | LMNA (0.56) | LMNACYP1A2GAAHPGDCHEK1 | |
| SCHEMBL30547019 | 0.75 | LMNA (0.56) | LMNACYP1A2GAAHPGDCHEK1 | |
| SCHEMBL8288846 | 0.75 | TP53 (0.56) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| SCHEMBL1720536 | 0.74 | PARP1 (0.45) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| SCHEMBL9384092 | 0.73 | PARP1 (1.00) | PARP1LMNATP53SMN1; SMN2CYP1A2 | |
| SCHEMBL4078132 | 0.73 | PARP1 (0.44) | PARP1LMNATP53SMN1; SMN2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1566380-B1 | ISOQUINOLINE COMPOUNDS AND MEDICINAL USE THEREOF | MITSUBISHI TANABE PHARMA CORP (JP) | 2012-01-11 | — | — | EP | disclosed |