Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | PDE9A | O76083 | 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 | |
|---|---|---|---|---|
| SCHEMBL23467063 | 1.00 | GRIN1 (0.35) | GRIN1GRIN2BKDM4CS1PR1RECQL | |
| SCHEMBL15687752 | 0.84 | ADORA2A (0.40) | GRIN1GRIN2BKDM4CPGRSYK | |
| SCHEMBL29770916 | 0.82 | PGR (0.41) | KDM4CRECQLPGRGRM4ALDH1A1 | |
| SCHEMBL23467054 | 0.82 | PGR (0.41) | KDM4CRECQLPGRGRM4ALDH1A1 | |
| SCHEMBL15970825 | 0.81 | SYK (0.42) | GRIN1GRIN2BS1PR1RECQLPGR | |
| SCHEMBL29770858 | 0.81 | SYK (0.42) | GRIN1GRIN2BS1PR1RECQLPGR | |
| SCHEMBL23467039 | 0.77 | KDM4C (0.40) | KDM4CKMT2APOLB | |
| SCHEMBL29770896 | 0.77 | KDM4C (0.40) | KDM4CKMT2APOLB | |
| SCHEMBL15687405 | 0.77 | SLC22A12 (0.44) | SLC22A12 | |
| SCHEMBL23467042 | 0.76 | GAA (0.44) | KDM4CSLC22A12MEN1ALDH1A1KMT2A |
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-114761401-A | Sphingosine-1-phosphate receptor agonists, method for the preparation thereof and pharmaceutical compositions containing the same as active ingredient | 株式会社LG化学 | 2022-07-15 | — | — | CN | disclosed |