Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 7/20 | 0.45 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.44 |
| ▸ | KIT | P10721 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8616109 | 0.92 | SIGMAR1 (0.55) | SIGMAR1P2RX7KITATML3MBTL1 | |
| SCHEMBL7854880 | 0.81 | SIGMAR1 (0.45) | SIGMAR1P2RX7ATML3MBTL1KCNH2 | |
| SCHEMBL7037039 | 0.78 | P2RX7 (0.48) | SIGMAR1P2RX7ATML3MBTL1KCNH2 | |
| SCHEMBL7860176 | 0.75 | KCNH2 (0.44) | SIGMAR1P2RX7KCNH2 | |
| SCHEMBL8716803 | 0.74 | KCNH2 (0.46) | SIGMAR1P2RX7L3MBTL1KCNH2 | |
| SCHEMBL7860301 | 0.73 | KCNH2 (0.45) | SIGMAR1P2RX7ATML3MBTL1KCNH2 | |
| SCHEMBL7039896 | 0.73 | KCNH2 (0.57) | SIGMAR1P2RX7KCNH2 | |
| SCHEMBL7861359 | 0.73 | KDM4E (0.46) | SIGMAR1P2RX7KCNH2MAPT | |
| SCHEMBL8075696 | 0.72 | SIGMAR1 (0.49) | SIGMAR1P2RX7KCNH2MAPT | |
| SCHEMBL7861681 | 0.72 | KCNH2 (0.60) | SIGMAR1P2RX7KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0830350-A4 | NOVEL N-(1-ALKYL-5-PHENYL-2,3,4,5-TETRAHYDRO-1H-BENZO[B][1,4]DIAZEPIN-3-YL)-ACETAMIDES | MERCK & CO INC (US) | 1998-09-30 | — | — | EP | claimed |
| EP-0830350-A1 | NOVEL N-(1-ALKYL-5-PHENYL-2,3,4,5-TETRAHYDRO-1H-BENZO[B][1,4]DIAZEPIN-3-YL)-ACETAMIDES | Merck & Co., Inc. (US) | 1998-03-25 | — | — | EP | claimed |
| WO-1996040653-A1 | NOVEL N-(1-ALKYL-5-PHENYL-2,3,4,5-TETRAHYDRO-1H-BENZO[B][1,4]DIAZEPIN-3-YL)-ACETAMIDES | MERCK & CO., INC. (US) | 1996-12-19 | — | — | WO | claimed |
| EP-0830350-B1 | N-(1-ALKYL-5-PHENYL-2,3,4,5-TETRAHYDRO-1H-BENZO[B][1,5]DIAZEPIN-3-YL)-ACETAMIDES | MERCK & CO INC (US) | 2001-10-04 | — | — | EP | disclosed |