Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 1/20 | 0.43 |
| ▸ | RAC1 | P63000 | 3/20 | 0.36 |
| ▸ | CDC42 | P60953 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.35 |
| ▸ | TP53 | P04637 | 3/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | FYN | P06241 | 3/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14904035 | 0.89 | PDCD1 (0.37) | TDO2MAPTSMN1; SMN2TP53CA12 | |
| SCHEMBL12075023 | 0.88 | FYN (0.36) | TDO2RAC1CDC42MAPTSMN1; SMN2 | |
| SCHEMBL12074701 | 0.83 | TDO2 (0.37) | TDO2MAPTSMN1; SMN2TP53CA12 | |
| SCHEMBL12074099 | 0.82 | TDO2 (0.36) | TDO2MAPTSMN1; SMN2TP53CA12 | |
| SCHEMBL14904034 | 0.79 | PDCD1 (0.39) | SMN1; SMN2FYNALDH1A1HPGDHSD17B10 | |
| SCHEMBL14904029 | 0.79 | PDE4A (0.36) | TDO2MAPTSMN1; SMN2TP53FYN | |
| SCHEMBL12074864 | 0.77 | MAPT (0.39) | TDO2RAC1MAPTSMN1; SMN2TP53 | |
| SCHEMBL12074127 | 0.76 | TDO2 (0.52) | TDO2FYNCHEK2 | |
| SCHEMBL12074251 | 0.72 | TDO2 (0.34) | TDO2MAPTSMN1; SMN2TP53CA12 | |
| SCHEMBL14904053 | 0.72 | TDO2 (0.33) | TDO2MAPTSMN1; SMN2TP53FYN |
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 |