Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 3/20 | 0.33 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.33 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | SLC10A2 | Q12908 | 1/20 | 0.31 |
| ▸ | PDE5A | O76074 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14904029 | 0.88 | PDE4A (0.36) | TDO2TP53MAPTSMN1; SMN2HSP90AA1 | |
| SCHEMBL12074099 | 0.88 | TDO2 (0.36) | TDO2TP53MAPTSMN1; SMN2CA12 | |
| SCHEMBL12074864 | 0.87 | MAPT (0.39) | TDO2TP53MAPTSMN1; SMN2HSP90AA1 | |
| SCHEMBL12074908 | 0.86 | ACACA (0.41) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL12074861 | 0.86 | SLC10A2 (0.44) | TDO2TP53MAPTSMN1; SMN2CA12 | |
| SCHEMBL12074251 | 0.84 | TDO2 (0.34) | TDO2TP53MAPTSMN1; SMN2CA12 | |
| SCHEMBL12074707 | 0.83 | TDO2 (0.43) | TDO2TP53MAPTSMN1; SMN2CA12 | |
| SCHEMBL12074091 | 0.80 | TGFBR1 (0.39) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL14904035 | 0.79 | PDCD1 (0.37) | TDO2TP53MAPTSMN1; SMN2CA12 | |
| SCHEMBL12074913 | 0.76 | PDGFRB (0.59) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011163610-A2 | ANTIMICROBIAL AGENTS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2011-12-29 | — | — | WO | disclosed |