Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | APAF1 | O14727 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.31 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.31 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12334104 | 1.00 | KCNH2 (0.35) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL12306316 | 1.00 | KCNH2 (0.35) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL12334100 | 0.90 | KCNH2 (0.35) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL12306317 | 0.90 | KCNH2 (0.35) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL14959764 | 0.90 | KCNH2 (0.35) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL14773851 | 0.89 | KCNH2 (0.43) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL2595984 | 0.89 | KCNH2 (0.43) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL1947682 | 0.89 | KCNH2 (0.43) | KCNH2NR1I2ESR1PGRPPARG | |
| SCHEMBL3085224 | 0.87 | KCNH2 (0.33) | KCNH2 | |
| SCHEMBL3085994 | 0.87 | KCNH2 (0.33) | KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8445476-B2 | Carbacephem β-lactam antibiotics | ACHAOGEN, INC. (US) | 2013-05-21 | — | — | US | disclosed |