Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.43 |
| ▸ | F10 | P00742 | 1/20 | 0.43 |
| ▸ | PYGL | P06737 | 2/20 | 0.43 |
| ▸ | PYGM | P11217 | 2/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.42 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | GRN | P28799 | 1/20 | 0.41 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.41 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL8083328 | 0.79 | ALDH1A1 (0.52) | CYP1A2CYP2C19MEN1KMT2ACYP3A4 | |
| SCHEMBL8760336 | 0.77 | CCKBR (0.61) | — | |
| SCHEMBL8761256 | 0.76 | CCKAR (0.62) | — | |
| SCHEMBL6005737 | 0.75 | CCKBR (0.39) | — | |
| SCHEMBL8075696 | 0.72 | SIGMAR1 (0.49) | KMT2AMAPT | |
| SCHEMBL7504905 | 0.71 | ALDH1A1 (0.61) | CYP1A2CYP2C19MEN1KMT2ACYP3A4 | |
| SCHEMBL8075665 | 0.71 | KCNH2 (0.49) | HPGDF10KDM4EALDH1A1MAPT | |
| SCHEMBL8616776 | 0.69 | CCKBR (0.46) | — | |
| SCHEMBL7506206 | 0.68 | PYGL (0.62) | MEN1KMT2ATAS1R3TAS1R2F10 | |
| SCHEMBL4419910 | 0.66 | GRN (0.63) | HPGDCYP1A2CYP2C19CYP2C9MEN1 |
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 7 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 |
| 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 |