Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.48 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.45 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 4/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | MLNR | O43193 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR5A | P47898 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27966164 | 0.82 | SIGMAR1 (0.62) | SIGMAR1MLNRMAPK14CNR2CXCR4 | |
| SCHEMBL7102078 | 0.81 | LMNA (0.55) | SIGMAR1LMNAHTR7PTPN11MAPK14 | |
| SCHEMBL2472212 | 0.80 | HTR7 (0.64) | SIGMAR1LMNAHTR7DRD2DRD4 | |
| SCHEMBL30616744 | 0.80 | HTR7 (0.64) | SIGMAR1LMNAHTR7DRD2DRD4 | |
| SCHEMBL7097670 | 0.80 | LMNA (0.49) | SIGMAR1PDCD1CD274LMNAHTR7 | |
| SCHEMBL376781 | 0.78 | HTR7 (0.56) | SIGMAR1LMNAHTR7MLNRCXCR4 | |
| SCHEMBL7098972 | 0.77 | HTR7 (0.59) | SIGMAR1PDCD1CD274LMNACYP1A2 | |
| Hydrochloric Acid SCHEMBL5689236 | 0.77 | HTR7 (0.55) | SIGMAR1LMNAHTR7MLNRCXCR4 | |
| Hydrochloric Acid SCHEMBL30688262 | 0.77 | HTR7 (0.55) | SIGMAR1LMNAHTR7MLNRCXCR4 | |
| Acetic Acid SCHEMBL11195900 | 0.75 | LMNA (0.50) | SIGMAR1LMNACYP1A2CYP3A4CYP2C19 |
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-1902014-A2 | GLUTAMATE AGGRECANASE INHIBITORS | Wyeth (US) | 2008-03-26 | — | — | EP | claimed |
| WO-2007008994-A2 | GLUTAMATE AGGRECANASE INHIBITORS | WYETH (US) | 2007-01-18 | — | — | WO | claimed |