Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | EEF2K | O00418 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | RAF1 | P04049 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.40 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | PRKDC | P78527 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30442171 | 0.74 | CRBN (0.57) | EEF2KALDH1A1TSHROPRM1 | |
| SCHEMBL23064465 | 0.71 | KEAP1 (0.52) | KEAP1NPC1EEF2KMAPK1ALDH1A1 | |
| SCHEMBL8704351 | 0.71 | EEF2K (0.46) | KEAP1NPC1EEF2KMAPK1ALDH1A1 | |
| SCHEMBL23064544 | 0.69 | PDCD1 (0.51) | KEAP1NPC1EEF2KMAPK1GAA | |
| SCHEMBL29559516 | 0.69 | SMN1; SMN2 (0.56) | KEAP1NPC1EEF2KMAPK1ALDH1A1 | |
| SCHEMBL27934132 | 0.69 | MAPK1 (0.74) | KEAP1NPC1MAPK1ALDH1A1MAPT | |
| SCHEMBL23064483 | 0.69 | KEAP1 (0.48) | KEAP1NPC1EEF2KMAPK1ALDH1A1 | |
| SCHEMBL11876685 | 0.69 | IDO1 (0.37) | ALDH1A1MAPTGAAKDM4EL3MBTL1 | |
| SCHEMBL31198346 | 0.69 | KEAP1 (0.48) | KEAP1NPC1EEF2KMAPK1ALDH1A1 | |
| SCHEMBL18701462 | 0.68 | HTR2C (0.50) | KEAP1MAPK1HTR1AADRA1BHTR6 |
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-1318406-C | New barbituric acid derivatives, processes for their prodn. and pharmaceutical agent contg. same | BOEHRINGER MANNHEIM GMBH (DE) | 2007-05-30 | — | — | CN | disclosed |