Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | CCKBR | P32239 | 11/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7046218 | 0.93 | CCKBR (0.55) | ALDH1A1KCNH2CCKBR | |
| SCHEMBL8088997 | 0.92 | KCNH2 (0.57) | ALDH1A1KCNH2MEN1KMT2AHSD17B10 | |
| SCHEMBL7042449 | 0.85 | KCNH2 (0.42) | ALDH1A1KCNH2MEN1KMT2AHSD17B10 | |
| SCHEMBL8075702 | 0.83 | ALDH1A1 (0.49) | ALDH1A1KCNH2MEN1KMT2AHSD17B10 | |
| SCHEMBL7854699 | 0.82 | KCNH2 (0.42) | ALDH1A1KCNH2CCKBRCYP3A4SIGMAR1 | |
| SCHEMBL8075698 | 0.80 | KCNH2 (0.44) | KCNH2CCKBRSIGMAR1 | |
| SCHEMBL7044179 | 0.78 | KCNH2 (0.59) | KCNH2CCKBR | |
| SCHEMBL8760307 | 0.78 | KCNH2 (0.76) | KCNH2CCKBR | |
| SCHEMBL8075805 | 0.78 | KCNH2 (0.56) | ALDH1A1KCNH2CCKBR | |
| SCHEMBL8075666 | 0.77 | KCNH2 (0.55) | ALDH1A1KCNH2MEN1KMT2AHSD17B10 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0832075-B1 | N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | MERCK & CO INC (US) | 2000-10-11 | — | — | EP | claimed |
| EP-0832075-A4 | NOVEL N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | MERCK & CO INC (US) | 1998-10-07 | — | — | EP | claimed |
| EP-0832075-A1 | NOVEL N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | Merck & Co., Inc. (US) | 1998-04-01 | — | — | EP | claimed |
| US-5691331-A | N-(2,4-Dioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-3yl) -3- amides | MERCK & CO., INC. (US) | 1997-11-25 | — | — | US | claimed |
| WO-1996040655-A1 | NOVEL N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | MERCK & CO., INC. (US) | 1996-12-19 | — | — | WO | claimed |
| EP-0832075-B1 | N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | MERCK & CO INC (US) | 2000-10-11 | — | — | EP | disclosed |
| EP-0832075-A4 | NOVEL N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | MERCK & CO INC (US) | 1998-10-07 | — | — | EP | disclosed |
| EP-0832075-A1 | NOVEL N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | Merck & Co., Inc. (US) | 1998-04-01 | — | — | EP | disclosed |
| US-5691331-A | N-(2,4-Dioxo-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-3yl) -3- amides | MERCK & CO., INC. (US) | 1997-11-25 | — | — | US | disclosed |
| WO-1996040655-A1 | NOVEL N-(2,4-DIOXO-2,3,4,5-TETRAHYDRO-1H-1,5-BENZODIAZEPIN-3Y L)-3-AMIDES | MERCK & CO., INC. (US) | 1996-12-19 | — | — | WO | disclosed |