Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5524497 | 0.88 | PARP1 (0.47) | PARP1NPC1RAB9ABCAT2KEAP1 | |
| SCHEMBL21439307 | 0.86 | MAPK8 (0.44) | PARP1KEAP1NFE2L2MAPTMEN1 | |
| SCHEMBL370726 | 0.84 | MYC (0.45) | PARP1BCAT2KEAP1NFE2L2MAPT | |
| SCHEMBL5476512 | 0.82 | BCAT2 (0.59) | PARP1NPC1RAB9ABCAT2KEAP1 | |
| SCHEMBL5478916 | 0.81 | MEN1 (0.44) | PARP1BCAT2KEAP1NFE2L2MEN1 | |
| SCHEMBL2964481 | 0.81 | PARP1 (0.45) | PARP1BCAT2KEAP1NFE2L2MAPT | |
| SCHEMBL28784267 | 0.80 | PARP1 (0.50) | PARP1NPC1RAB9ABCAT2KEAP1 | |
| SCHEMBL2113823 | 0.77 | NPC1 (0.59) | PARP1NPC1RAB9ABCAT2KEAP1 | |
| SCHEMBL28204604 | 0.77 | CD38 (0.45) | PARP1MAPTMEN1NR1I2LMNA | |
| SCHEMBL5482646 | 0.77 | PPARG (0.45) | PARP1NPC1RAB9ABCAT2MAPT |
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-1763509-A1 | ALPHA-HELICAL MIMETICS | THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) | 2007-03-21 | — | — | EP | disclosed |
| WO-2006002474-A1 | ALPHA-HELICAL MIMETICS | THE WALTER AND ELIZA HALL INSTITUTE OF MEDICAL RESEARCH (AU) | 2006-01-12 | — | — | WO | disclosed |