Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 4/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMO | O15229 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | MPL | P40238 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21452878 | 0.98 | KIF11 (0.43) | KIF11FAAHCYP1A2CYP3A4CLK4 | |
| SCHEMBL21452945 | 0.85 | KIF11 (0.41) | KIF11FAAHCYP1A2CYP3A4CLK4 | |
| SCHEMBL21434040 | 0.85 | FAAH (0.43) | FAAHCYP3A4TDO2KMOTRPA1 | |
| SCHEMBL21434173 | 0.82 | FAAH (0.43) | FAAHCYP3A4TDO2KMOTRPA1 | |
| SCHEMBL21452790 | 0.82 | FAAH (0.41) | KIF11FAAHCYP3A4KMOCYP11B2 | |
| SCHEMBL21434049 | 0.78 | FAAH (0.44) | FAAHCYP1A2CYP3A4CLK4TSHR | |
| SCHEMBL582158 | 0.71 | KDM4E (0.53) | KIF11KMOCYP11B2CYP11B1SYK | |
| SCHEMBL21433993 | 0.71 | FAAH (0.42) | FAAHCYP3A4KMOTRPA1TRPV4 | |
| SCHEMBL21453072 | 0.70 | FAAH (0.39) | KIF11FAAHCYP11B2CYP11B1TRPA1 | |
| SCHEMBL21434083 | 0.70 | PDK2 (0.42) | FAAHCYP3A4KMOTRPA1TRPV4 |
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-2019193516-A2 | SUBSTITUTED PYRIDINE AND PYRIMIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2019-10-10 | — | — | WO | disclosed |