Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UBE2M | P61081 | 1/20 | 0.53 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.53 |
| ▸ | SIGMAR1 | Q99720 | 11/20 | 0.52 |
| ▸ | SLC6A12 | P48065 | 1/20 | 0.49 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | DRD3 | P35462 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5402061 | 0.84 | SIGMAR1 (0.68) | SIGMAR1SLC6A12TMEM97MCHR1L3MBTL1 | |
| SCHEMBL27890304 | 0.84 | DRD4 (0.50) | UBE2MDCUN1D1SIGMAR1SLC6A12TMEM97 | |
| SCHEMBL2349196 | 0.83 | DRD4 (0.54) | UBE2MDCUN1D1SIGMAR1MCHR1DRD4 | |
| SCHEMBL12280116 | 0.83 | DRD4 (0.54) | UBE2MDCUN1D1SIGMAR1MCHR1DRD4 | |
| SCHEMBL14800843 | 0.80 | SMN1; SMN2 (0.56) | KMT2A | |
| SCHEMBL4390012 | 0.80 | DRD4 (0.65) | SIGMAR1MCHR1DRD4DRD2CHRM2 | |
| SCHEMBL6865672 | 0.80 | DRD4 (0.65) | SIGMAR1MCHR1DRD4DRD2CHRM2 | |
| SCHEMBL12965729 | 0.77 | HDAC3 (0.62) | — | |
| SCHEMBL2221237 | 0.76 | UBE2M (0.60) | UBE2MDCUN1D1SIGMAR1L3MBTL1DRD4 | |
| SCHEMBL2221234 | 0.76 | UBE2M (0.60) | UBE2MDCUN1D1SIGMAR1L3MBTL1DRD4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2760857-A1 | PYRAZOL-4-YL-HETEROCYCLYL-CARBOXAMIDE COMPOUNDS AND METHODS OF USE | F.HOFFMANN-LA ROCHE AG (CH) | 2014-08-06 | — | — | EP | disclosed |
| WO-2013045461-A1 | PYRAZOL-4-YL-HETEROCYCLYL-CARBOXAMIDE COMPOUNDS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2013-04-04 | — | — | WO | disclosed |