Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 4/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27686312 | 0.93 | GRIN1 (0.37) | GRIN1GRIN2BHTTS1PR3GRM2 | |
| SCHEMBL28765661 | 0.87 | GRM2 (0.36) | GRIN1GRIN2BGRM2FEN1KDM4E | |
| SCHEMBL27686188 | 0.87 | GRIN1 (0.40) | GRIN1GRIN2BGRM2FEN1GABRA1 | |
| SCHEMBL27686094 | 0.86 | S1PR3 (0.39) | GRIN1GRIN2BHTTS1PR3GRM2 | |
| SCHEMBL27667139 | 0.85 | GRIN1 (0.37) | GRIN1GRIN2BHTTS1PR3GRM2 | |
| SCHEMBL27686159 | 0.84 | CNR2 (0.34) | GRM2 | |
| SCHEMBL27686115 | 0.84 | DPP4 (0.34) | GRIN2BHTTGRM2KDM4EALDH1A1 | |
| SCHEMBL27667153 | 0.83 | TRPC5 (0.38) | GRM2 | |
| SCHEMBL27686289 | 0.82 | LMNA (0.33) | GRIN1GRIN2BGRM2LMNA | |
| SCHEMBL27685962 | 0.81 | MEN1 (0.37) | GRIN2BGRM2KDM4E |
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-1976915-A | HIV integrase inhibitors | SMITHKLINE BEECHAM CORP (US) | 2007-06-06 | — | — | CN | disclosed |