Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 3/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | BAX | Q07812 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 2/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ACACB | O00763 | 1/20 | 0.36 |
| ▸ | ACACA | Q13085 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6672417 | 0.91 | ESR1 (0.41) | KMT2AESR1ESR2NPY5RALDH1A1 | |
| SCHEMBL6673967 | 0.78 | KDM4E (0.41) | KDM4EALDH1A1 | |
| SCHEMBL6673764 | 0.77 | ESR1 (0.39) | ESR1ESR2NPY5RCYP2C9 | |
| SCHEMBL27996252 | 0.70 | MEN1 (0.54) | MEN1KMT2AESR1ESR2LTA4H | |
| SCHEMBL6563846 | 0.69 | AKR1C3 (0.55) | MEN1KMT2AESR1ESR2LTA4H | |
| SCHEMBL12804466 | 0.69 | ESR1 (0.73) | MEN1KMT2AESR1ESR2LTA4H | |
| SCHEMBL3148095 | 0.69 | ESR1 (0.64) | MEN1KMT2AESR1ESR2LTA4H | |
| SCHEMBL22074727 | 0.68 | BLM (0.47) | ESR1ESR2ALDH1A1CYP2C9HSD17B10 | |
| SCHEMBL22074723 | 0.68 | BLM (0.47) | ESR1ESR2ALDH1A1CYP2C9HSD17B10 | |
| SCHEMBL25597560 | 0.68 | BLM (0.47) | ESR1ESR2ALDH1A1CYP2C9HSD17B10 |
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-0048159-A2 | Novel carboxyalkyl peptides and thioethers and ethers of peptides as antihypertensive agents | UNIVERSITY OF MIAMI (US) | 1982-03-24 | — | — | EP | disclosed |