Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 7/20 | 0.37 |
| ▸ | TNKS | O95271 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | XIAP | P98170 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7819208 | 0.89 | KCNH2 (0.49) | KCNH2P2RX7CCKBR | |
| SCHEMBL7816350 | 0.86 | KCNH2 (0.53) | KCNH2P2RX7TNKSTNKS2PARP2 | |
| SCHEMBL8075665 | 0.80 | KCNH2 (0.49) | KCNH2P2RX7TNKSTNKS2PARP2 | |
| SCHEMBL8800786 | 0.80 | KCNH2 (0.45) | KCNH2P2RX7TNKSTNKS2PARP2 | |
| SCHEMBL7817774 | 0.79 | KCNH2 (0.48) | KCNH2P2RX7TNKSTNKS2PARP2 | |
| SCHEMBL8761175 | 0.77 | KCNH2 (0.71) | KCNH2CCKBR | |
| SCHEMBL8761087 | 0.77 | KCNH2 (0.71) | KCNH2CCKBR | |
| SCHEMBL9266063 | 0.76 | KCNH2 (0.59) | KCNH2P2RX7TNKSTNKS2PARP2 | |
| SCHEMBL7817094 | 0.75 | KCNH2 (0.55) | KCNH2P2RX7CCKBR | |
| SCHEMBL7046124 | 0.74 | CCKBR (0.49) | KCNH2P2RX7TNKSTNKS2PARP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0730581-B1 | 3-ACYLAMINOBENZAZEPINES | MERCK & CO INC (US) | 2001-10-04 | — | — | EP | disclosed |
| US-5696111-A | ANTIARRHYTHMIC AGENTS | MERCK & CO., INC. (US) | 1997-12-09 | — | — | US | disclosed |
| WO-1995014671-A1 | 3-ACYLAMINOBENZAZEPINES | MERCK & CO., INC. (US) | 1995-06-01 | — | — | WO | disclosed |