Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KAT2B | Q92831 | 1/20 | 0.59 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 11/20 | 0.47 |
| ▸ | PDE4A | P27815 | 6/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.47 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.46 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.42 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | GGT1 | P19440 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1815278 | 1.00 | KAT2B (0.59) | KAT2BBAZ2BPDE4DPDE4APDE4B | |
| SCHEMBL8890812 | 0.91 | KAT2B (0.71) | KAT2BBAZ2BPDE4DGRIK1GRIA2 | |
| SCHEMBL31056850 | 0.87 | KAT2B (0.50) | KAT2BBAZ2BGRIK1GRIA2EPHX2 | |
| SCHEMBL3441348 | 0.87 | KAT2B (0.58) | KAT2BBAZ2BPDE4DPDE4APDE4B | |
| SCHEMBL1811109 | 0.84 | KAT2B (0.63) | KAT2BBAZ2BPDE4DPDE4APDE4B | |
| SCHEMBL2354090 | 0.84 | KAT2B (0.56) | KAT2BBAZ2BPDE4DPDE4APDE4B | |
| SCHEMBL1811110 | 0.84 | KAT2B (0.63) | KAT2BBAZ2BPDE4DPDE4APDE4B | |
| SCHEMBL20561976 | 0.82 | EPHX2 (0.58) | KAT2BBAZ2BGRIK1GRIA2EPHX2 | |
| SCHEMBL29993812 | 0.82 | KAT2B (0.53) | KAT2BBAZ2BPDE4DPDE4APDE4B | |
| SCHEMBL1672509 | 0.80 | PDE4D (0.46) | KAT2BBAZ2BPDE4DPDE4APDE4B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011061590-A1 | NOVEL CARBOXAMIDE DERIVATIVES AS HIV INHIBITORS | HETERO RESEARCH FOUNDATION (IN) | 2011-05-26 | — | — | WO | disclosed |
| WO-2011061590-A1 | NOVEL CARBOXAMIDE DERIVATIVES AS HIV INHIBITORS | HETERO RESEARCH FOUNDATION (IN) | 2011-05-26 | — | — | WO | disclosed |