Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | RET | P07949 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18230342 | 0.89 | ADORA2A (0.44) | PTGESADORA2AADORA1ADORA3HTT | |
| SCHEMBL18230503 | 0.81 | ADORA2A (0.45) | ADORA2AADORA1ADORA3RAB9AHTT | |
| SCHEMBL18230364 | 0.81 | ADORA2A (0.42) | ADORA2AADORA1ADORA3RAB9AMAPT | |
| SCHEMBL18230284 | 0.81 | ADORA2A (0.39) | ADORA2AADORA1ADORA3RAB9AHTT | |
| SCHEMBL18230271 | 0.81 | NOX1 (0.40) | ADORA2AADORA1ADORA3RAB9AHTT | |
| SCHEMBL18230334 | 0.81 | KDM4E (0.44) | ADORA2AADORA1ADORA3RAB9AHTT | |
| SCHEMBL18230321 | 0.81 | ADORA2A (0.48) | ADORA2AADORA1ADORA3HTTMAPT | |
| SCHEMBL18230296 | 0.81 | TRPV1 (0.54) | ADORA2AADORA1ADORA3HTTMAPT | |
| SCHEMBL18230513 | 0.80 | TLR7 (0.49) | ADORA2AADORA1MAPTPOLBLMNA | |
| SCHEMBL18230361 | 0.78 | ADORA3 (0.46) | ADORA2AADORA1ADORA3HTTMAPT |
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-2016183173-A1 | ANTIPARASITIC COMPOUNDS | Avista Pharma Solutions (US) | 2016-11-17 | — | — | WO | disclosed |
| WO-2016183173-A1 | ANTIPARASITIC COMPOUNDS | Avista Pharma Solutions (US) | 2016-11-17 | — | — | WO | disclosed |