Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| N-Methylpiperidine SCHEMBL11427242 | 0.98 | FDPS (0.37) | FDPSMMP1MMP2MMP3MMP9 | |
| N-Methyl Pyrrolidine (Nmp) SCHEMBL21616463 | 0.82 | FDPS (0.40) | FDPSMMP1MMP2MMP3MMP9 | |
| N-Methyl Pyrrolidine (Nmp) SCHEMBL28988048 | 0.82 | FDPS (0.40) | FDPSMMP1MMP2MMP3MMP9 | |
| SCHEMBL5576823 | 0.81 | CYP1A2 (0.31) | CYP1A2TDP1 | |
| N-Methylpiperidine SCHEMBL21616459 | 0.79 | MAPT (0.44) | FDPSMMP1MMP2MMP3MMP9 | |
| Phosphine SCHEMBL28145112 | 0.76 | CA2 (0.33) | FDPSMMP1MMP2MMP9TDP1 | |
| SCHEMBL28223995 | 0.76 | CA2 (0.43) | FDPSMMP1MMP2MMP9TDP1 | |
| SCHEMBL47754 | 0.76 | — | — | |
| SCHEMBL21616468 | 0.74 | FDPS (0.32) | FDPSMMP1MMP2MMP3MMP9 | |
| SCHEMBL23276929 | 0.73 | CA2 (0.35) | FDPSTDP1CA2 |
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-2011000490-A2 | SYNTHESIS OF IONIC LIQUIDS | MERCK PATENT GMBH (DE) | 2011-01-06 | — | — | WO | disclosed |