Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL27796221 | 0.72 | PARP1 (0.32) | HPGDTP53MAPTALDH1A1 | |
| SCHEMBL27817508 | 0.70 | KMT2A (0.54) | LMNAKMT2AHPGDMEN1TP53 | |
| SCHEMBL917974 | 0.70 | CYP2A6 (0.39) | — | |
| SCHEMBL27796234 | 0.69 | ALDH1A1 (0.44) | LMNAPOLBKMT2AHPGDMEN1 | |
| SCHEMBL14836896 | 0.67 | PARP1 (0.48) | KMT2AHPGDMEN1ALDH1A1 | |
| SCHEMBL917709 | 0.67 | KDM4E (0.48) | LMNAPOLBKMT2ASMN1; SMN2KDM4E | |
| SCHEMBL27796285 | 0.67 | HDAC1 (0.48) | POLBKMT2AMEN1TP53ALDH1A1 | |
| SCHEMBL14837200 | 0.66 | PARP1 (0.43) | LMNAKMT2AHPGDMEN1MAPT | |
| SCHEMBL918232 | 0.66 | PARP1 (0.35) | KMT2AMEN1SMN1; SMN2ALDH1A1 | |
| SCHEMBL918234 | 0.65 | PARP1 (0.34) | — |
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-1758864-B1 | Substituted tetrahydro-2H-isoquinolin-1-one derivatives, method for their preparation, and their use as medicaments | SANOFI AVENTIS DEUTSCHLAND (DE) | 2013-04-10 | — | — | EP | disclosed |