Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GHSR | Q92847 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 4/20 | 0.33 |
| ▸ | DRD4 | P21917 | 4/20 | 0.33 |
| ▸ | DRD3 | P35462 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9103333 | 0.95 | GHSR (0.49) | GHSRTP53AGTR1POLBMEN1 | |
| SCHEMBL9103038 | 0.94 | GHSR (0.48) | GHSRTP53AGTR1POLBMEN1 | |
| SCHEMBL9102792 | 0.92 | GHSR (0.42) | GHSRTP53AGTR1POLBMEN1 | |
| SCHEMBL9106352 | 0.92 | GHSR (0.51) | GHSRTP53AGTR1POLBKMT2A | |
| SCHEMBL9102903 | 0.92 | GHSR (0.55) | GHSRTP53AGTR1POLBKMT2A | |
| SCHEMBL9104172 | 0.91 | GHSR (0.50) | GHSRAGTR1POLBALDH1A1XIAP | |
| SCHEMBL9106874 | 0.91 | GHSR (0.49) | GHSRTP53AGTR1POLBKMT2A | |
| SCHEMBL7785931 | 0.90 | GHSR (0.51) | GHSRAGTR1DRD2DRD4DRD3 | |
| SCHEMBL9104909 | 0.90 | GHSR (0.59) | GHSRAGTR1POLBMEN1KMT2A | |
| SCHEMBL7796095 | 0.89 | GHSR (0.51) | GHSRAGTR1DRD2DRD4DRD3 |
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 |
|---|---|---|---|---|---|---|---|
| US-5430144-A | E.g, N-(1-((2'-((methoxycarbonyl)amino)(1,1'-biphenyl)-4-yl) methyl)-2,3,4,5-tetrahydro-2-oxo-1H-1-benzazepin-3-yl)-3 ((fur-2-yl)methyl)amino-3-methylbutanamide | MERCK & CO., INC. (US) | 1995-07-04 | — | — | US | disclosed |