Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 3/20 | 0.51 |
| ▸ | CTSS | P25774 | 2/20 | 0.51 |
| ▸ | TLR2 | O60603 | 6/20 | 0.49 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL19851698 | 0.90 | TLR2 (0.63) | CTSKCTSSTLR2 | |
| SCHEMBL19851522 | 0.85 | TLR2 (0.70) | TLR2SIRT6SIRT1CA1CA2 | |
| SCHEMBL19851525 | 0.85 | TLR2 (0.70) | TLR2SIRT6SIRT1CA1CA2 | |
| SCHEMBL20542796 | 0.81 | CTSK (0.70) | CTSKCTSSSIRT6SIRT1CA1 | |
| SCHEMBL20542797 | 0.81 | CTSK (0.70) | CTSKCTSSSIRT6SIRT1CA1 | |
| SCHEMBL12179560 | 0.81 | TDP1 (0.58) | CTSKCTSSCA1CA2CXCR3 | |
| SCHEMBL16572097 | 0.79 | CTSK (0.60) | CTSKCTSSSIRT6SIRT1CA1 | |
| SCHEMBL19543629 | 0.79 | CTSS (0.53) | CTSKCTSSCA1CA2CXCR3 | |
| SCHEMBL12179561 | 0.79 | CTSS (0.55) | CTSKCTSSCA1CA2CXCR3 | |
| SCHEMBL16520542 | 0.78 | CTSK (0.65) | CTSKCTSSSIRT6SIRT1MEN1 |
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-2018026866-A1 | LIPID-SUBSTITUTED AMINO 1,2-AND 1,3-DIOL COMPOUNDS AS MODULATORS OF TLR2 DIMERIZATION | NEUROPORE THERAPIES, INC. (US) | 2018-02-08 | — | — | WO | disclosed |