Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.37 |
| ▸ | PPARG | P37231 | 7/20 | 0.37 |
| ▸ | PPARD | Q03181 | 7/20 | 0.37 |
| ▸ | PPARA | Q07869 | 7/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11293412 | 0.85 | CES2 (0.45) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL789713 | 0.83 | HSD17B10 (0.47) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL11289701 | 0.82 | CES2 (0.42) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL7855736 | 0.82 | EPHX1 (0.43) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL10529861 | 0.81 | HSD17B10 (0.50) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL6907432 | 0.81 | HSD17B10 (0.50) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL1276540 | 0.78 | CES2 (0.47) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL561899 | 0.77 | EPHX1 (0.46) | HSD17B10GMNNTP53POLBMAPT | |
| SCHEMBL11722997 | 0.77 | CES1 (0.38) | HSD17B10GMNNTP53POLBMAPT | |
| Carbamic Acid SCHEMBL29232548 | 0.76 | EPHX1 (0.46) | HSD17B10GMNNTP53POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0012401-A1 | Carboxyalkyl dipeptide derivatives, process for preparing them and pharmaceutical composition containing them | MERCK & CO. INC. (US) | 1980-06-25 | — | — | EP | claimed |