Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 4/20 | 0.53 |
| ▸ | MC1R | Q01726 | 4/20 | 0.53 |
| ▸ | MC3R | P41968 | 3/20 | 0.53 |
| ▸ | CTSB | P07858 | 1/20 | 0.48 |
| ▸ | CTSS | P25774 | 1/20 | 0.48 |
| ▸ | CTSK | P43235 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.48 |
| ▸ | MMP3 | P08254 | 1/20 | 0.48 |
| ▸ | MMP9 | P14780 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | TGM2 | P21980 | 1/20 | 0.46 |
| ▸ | MC5R | P33032 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19839739 | 0.92 | MC4R (0.52) | MC4RMC1RMC3RCTSBCTSS | |
| SCHEMBL19839742 | 0.92 | MC4R (0.52) | MC4RMC1RMC3RCTSBCTSS | |
| SCHEMBL19851498 | 0.85 | MC4R (0.51) | MC4RMC1RMC3RCTSBCTSS | |
| SCHEMBL19851484 | 0.80 | TLR2 (0.61) | MC4RMC1RMC3RCA1CA2 | |
| SCHEMBL19839774 | 0.80 | MC4R (0.57) | MC4RMC1RMC3RMMP1MMP3 | |
| SCHEMBL19839686 | 0.80 | MEN1 (0.55) | CTSKMMP1MMP3MMP9CA1 | |
| SCHEMBL19839673 | 0.80 | MEN1 (0.55) | CTSKMMP1MMP3MMP9CA1 | |
| SCHEMBL19839675 | 0.80 | MEN1 (0.55) | CTSKMMP1MMP3MMP9CA1 | |
| SCHEMBL19839775 | 0.80 | MC4R (0.57) | MC4RMC1RMC3RMMP1MMP3 | |
| SCHEMBL19839791 | 0.79 | CA1 (0.52) | CTSSCTSKMMP9CA1CA2 |
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 |