Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | TLR2 | O60603 | 2/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.42 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.42 |
| ▸ | PAM | P19021 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.41 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.40 |
| ▸ | MC5R | P33032 | 1/20 | 0.40 |
| ▸ | MC3R | P41968 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL2914250 | 0.81 | GAA (0.50) | MMP9PIN1MAOBPAMFOLH1 | |
| SCHEMBL2914248 | 0.81 | GAA (0.50) | MMP9PIN1MAOBPAMFOLH1 | |
| SCHEMBL6694861 | 0.80 | NOS2 (0.51) | MMP2MMP9MAOBCA1CA2 | |
| SCHEMBL6694863 | 0.80 | NOS2 (0.51) | MMP2MMP9MAOBCA1CA2 | |
| SCHEMBL6713032 | 0.80 | NOS2 (0.51) | MMP2MMP9MAOBCA1CA2 | |
| SCHEMBL28977231 | 0.80 | NOS2 (0.51) | MMP2MMP9MAOBCA1CA2 | |
| SCHEMBL4738732 | 0.78 | CA1 (0.51) | MMP2MMP9CA1CA2FOLH1 | |
| SCHEMBL4738722 | 0.78 | CA1 (0.51) | MMP2MMP9CA1CA2FOLH1 | |
| SCHEMBL4738726 | 0.78 | CA1 (0.51) | MMP2MMP9CA1CA2FOLH1 | |
| SCHEMBL16861027 | 0.78 | FOLH1 (0.50) | MMP2MMP9TLR2CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017053864-A1 | CYSTEINE PROTEASE INHIBITORS | INTRACELLULAR TECHNOLOGIES, LLC (US) | 2017-03-30 | — | — | WO | disclosed |