Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | DCK | P27707 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL19965080 | 0.81 | LMNA (0.38) | MAP4K4FFAR4LMNAPIM1PIM2 | |
| SCHEMBL19965054 | 0.74 | MAP3K5 (0.47) | CYP1A2CYP2C9CYP2C19MAP4K4PIM1 | |
| SCHEMBL19965064 | 0.74 | CYP1A2 (0.41) | CYP1A2CYP2C9CYP2C19MAP4K4FFAR4 | |
| SCHEMBL21124601 | 0.73 | FFAR4 (0.60) | CYP1A2CYP2C9CYP2C19MAP4K4FFAR4 | |
| SCHEMBL30918019 | 0.71 | CASP6 (0.42) | CYP1A2CYP2C9CYP2C19MAPTLMNA | |
| SCHEMBL19965171 | 0.70 | BRAF (0.36) | MAP4K4FFAR4LMNAHRH3GRM5 | |
| SCHEMBL6791132 | 0.69 | HTR3A (0.55) | CYP1A2CYP2C9CYP2C19MAP4K4DCK | |
| SCHEMBL8115420 | 0.68 | MAP4K4 (0.59) | CYP1A2CYP2C9CYP2C19MAP4K4SCN5A | |
| SCHEMBL959384 | 0.68 | L3MBTL1 (0.57) | CYP1A2CYP2C9CYP2C19MAP4K4PIM1 | |
| SCHEMBL19965170 | 0.65 | KDM4E (0.39) | CYP1A2CYP2C9CYP2C19HTR1A |
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-2018049324-A1 | MONOCYCLIC COMPOUNDS USEFUL AS GPR120 MODULATORS | NUMERATE, INC. (US) | 2018-03-15 | — | — | WO | disclosed |