Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.39 |
| ▸ | LNPEP | Q9UIQ6 | 2/20 | 0.39 |
| ▸ | KISS1R | Q969F8 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 2/20 | 0.37 |
| ▸ | FURIN | P09958 | 1/20 | 0.37 |
| ▸ | PCSK6 | P29122 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | REN | P00797 | 1/20 | 0.36 |
| ▸ | GNPAT | O15228 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 2/20 | 0.36 |
| ▸ | FCER2 | P06734 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL20951072 | 1.00 | ALDH1A1 (0.53) | ALDH1A1ERAP2ERAP1LNPEPKISS1R | |
| SCHEMBL20951073 | 1.00 | ALDH1A1 (0.53) | ALDH1A1ERAP2ERAP1LNPEPKISS1R | |
| SCHEMBL14932683 | 0.91 | ALDH1A1 (0.58) | ALDH1A1ERAP2ERAP1LNPEPKISS1R | |
| SCHEMBL30493601 | 0.91 | ALDH1A1 (0.58) | ALDH1A1ERAP2ERAP1LNPEPKISS1R | |
| SCHEMBL15810880 | 0.88 | ALDH1A1 (0.67) | ALDH1A1MMP2MMP9MMP8HPGDS | |
| SCHEMBL7669779 | 0.88 | ALDH1A1 (0.67) | ALDH1A1MMP2MMP9MMP8HPGDS | |
| SCHEMBL7669784 | 0.88 | ALDH1A1 (0.67) | ALDH1A1MMP2MMP9MMP8HPGDS | |
| SCHEMBL22367094 | 0.87 | ALDH1A1 (0.50) | ALDH1A1ERAP2ERAP1LNPEPKISS1R | |
| SCHEMBL20950949 | 0.87 | ALDH1A1 (0.50) | ALDH1A1ERAP2ERAP1LNPEPKISS1R | |
| SCHEMBL20950951 | 0.87 | ALDH1A1 (0.50) | ALDH1A1ERAP2ERAP1LNPEPKISS1R |
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-3700545-A1 | DIPEPTIDE ANALOGS AS TGF-BETA INHIBITORS | Southern Research Institute (US) | 2020-09-02 | — | — | EP | disclosed |