Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 9/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 9/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.39 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28029213 | 0.89 | ADORA2A (0.44) | GRIN1GRIN2BMTOREPHX2ADORA2A | |
| SCHEMBL28029238 | 0.87 | MTOR (0.44) | GRIN1GRIN2BMTORADORA2AMEN1 | |
| SCHEMBL28029224 | 0.87 | MTOR (0.43) | GRIN1GRIN2BMTORRXFP1ADORA2A | |
| SCHEMBL28029222 | 0.87 | CYP1A2 (0.54) | GRIN1GRIN2BMTORADORA2AABCG2 | |
| SCHEMBL28028900 | 0.84 | ADORA2A (0.46) | MTOREPHX2ADORA2AMEN1USP2 | |
| SCHEMBL28198777 | 0.84 | PIK3CA (0.44) | MTORABCG2MEN1USP2LMNA | |
| SCHEMBL28028874 | 0.84 | MTOR (0.47) | MTORADORA2AMEN1USP2LMNA | |
| SCHEMBL28855796 | 0.83 | MEN1 (0.41) | GRIN1GRIN2BTHRBMTORADORA2A | |
| SCHEMBL28028875 | 0.83 | MTOR (0.42) | GRIN1GRIN2BMTOREPHX2RXFP1 | |
| SCHEMBL28821952 | 0.83 | MTOR (0.47) | MTORADORA2AMEN1USP2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-104870998-A | Inhibition of phosphorylation of PRAS40, GSK 3-beta or P70S6K1 as a marker of TOR kinase inhibitory activity | SIGNAL PHARM LLC | 2015-08-26 | — | — | CN | disclosed |