Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28796749 | 1.00 | OPRD1 (0.47) | OPRD1SIGMAR1SLC6A4SLC6A3GRIN2D | |
| SCHEMBL10318991 | 0.85 | SLC6A4 (0.47) | SIGMAR1SLC6A4SLC6A3GRIN2DGRIN3B | |
| SCHEMBL10320886 | 0.81 | GRIN2D (0.46) | OPRD1SIGMAR1SLC6A4SLC6A3GRIN2D | |
| SCHEMBL15830257 | 0.79 | PRMT5 (0.51) | — | |
| Hydrochloric Acid SCHEMBL5557210 | 0.77 | RAD52 (0.51) | OPRD1SIGMAR1MAPK1RAD52 | |
| SCHEMBL10320357 | 0.76 | ABCB1 (0.47) | SIGMAR1MAPK1 | |
| SCHEMBL27847948 | 0.76 | ABCB1 (0.47) | SIGMAR1MAPK1 | |
| SCHEMBL10321875 | 0.76 | ABCB1 (0.47) | SIGMAR1MAPK1 | |
| SCHEMBL8281045 | 0.72 | TSHR (0.45) | SLC6A4SLC6A3ADRA1ASLC6A2TSHR | |
| SCHEMBL31444934 | 0.72 | TSHR (0.45) | SLC6A4SLC6A3ADRA1ASLC6A2TSHR |
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-102421778-A | Dihydropteridinone derivatives, preparation process and pharmaceutical use thereof | JIANGSU HENGRUI MEDICINE CO | 2012-04-18 | — | — | CN | disclosed |