Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RYR2 | Q92736 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 7/20 | 0.36 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | PARP10 | Q53GL7 | 5/20 | 0.34 |
| ▸ | PARP1 | P09874 | 4/20 | 0.34 |
| ▸ | PARP11 | Q9NR21 | 3/20 | 0.34 |
| ▸ | F7 | P08709 | 1/20 | 0.34 |
| ▸ | F3 | P13726 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.32 |
| ▸ | CDK1 | P06493 | 1/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10226478 | 0.78 | GAA (0.43) | RYR2GRIN2DGRIN3BGRIN1GRIN2A | |
| SCHEMBL9635151 | 0.74 | PARP10 (0.50) | RYR2PARP10PARP1PARP11F7 | |
| SCHEMBL26942243 | 0.74 | PARP10 (0.54) | RYR2PARP10PARP1PARP11GAA | |
| SCHEMBL2600209 | 0.74 | RYR2 (0.66) | RYR2PARP10PARP1PARP11GAA | |
| SCHEMBL9635206 | 0.74 | RYR2 (0.40) | RYR2HSP90AA1PARP10PARP1PARP11 | |
| SCHEMBL9635092 | 0.73 | RYR2 (0.52) | RYR2HSP90AA1PARP10PARP1PARP11 | |
| SCHEMBL15471838 | 0.72 | PARP10 (0.56) | PARP10PARP1PARP11F7F3 | |
| SCHEMBL9635291 | 0.71 | RYR2 (0.50) | RYR2HSP90AA1GRIN2DGRIN3BGRIN1 | |
| SCHEMBL28443875 | 0.68 | RYR2 (0.43) | RYR2PARP10PARP1PARP11F7 | |
| SCHEMBL1238947 | 0.68 | RYR2 (0.61) | RYR2PARP10PARP1GAARAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0368063-B1 | PROCESS FOR THE CHLORINATION IN THE NUCLEUS OF AROMATIC HYDROCARBONS | BAYER AG (DE) | 1992-06-10 | — | — | EP | disclosed |
| US-4990707-A | Process for the ring chlorination of aromatic hydrocarbons | BAYER AKTIENGESELLSCHAFT (DE) | 1991-02-05 | — | — | US | disclosed |