Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28236700 | 0.94 | TLR7 (0.40) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL28867968 | 0.90 | PDE4A (0.37) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL1978411 | 0.88 | AGTR1 (0.44) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL27690028 | 0.85 | AGTR1 (0.41) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL28151261 | 0.82 | ALPG (0.40) | ALDH1A1KMT2ATLR8PARP1KDM4E | |
| SCHEMBL729229 | 0.82 | AGTR1 (0.40) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL18686228 | 0.82 | AGTR1 (0.40) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL31647881 | 0.80 | PARP1 (0.36) | PARP1 | |
| SCHEMBL28785277 | 0.80 | BCHE (0.43) | AGTR1AGTR2ALDH1A1KMT2APOLB | |
| SCHEMBL30094773 | 0.78 | LMNA (0.43) | ALDH1A1KMT2APOLBLMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3157523-A1 | MULTIFUNCTIONAL AMINOQUINOLINE THERAPEUTIC AGENTS | Lohocla Research Corporation (US) | 2017-04-26 | — | — | EP | disclosed |
| WO-2015195943-A1 | MULTIFUNCTIONAL AMINOQUINOLINE THERAPEUTIC AGENTS | LOHOCLA RESEARCH CORPORATION (US) | 2015-12-23 | — | — | WO | disclosed |
| WO-2009046098-A1 | NOVEL CYCLIC BORONATE INHIBITORS OF HCV REPLICATION | SMITHKLINE BEECHAM CORPORATION (US) | 2009-04-09 | — | — | WO | disclosed |