Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 4/20 | 0.36 |
| ▸ | ITGB1 | P05556 | 3/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.36 |
| ▸ | PPARA | Q07869 | 5/20 | 0.36 |
| ▸ | PPARD | Q03181 | 4/20 | 0.36 |
| ▸ | PPARG | P37231 | 4/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.35 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.35 |
| ▸ | KIFC1 | Q9BW19 | 1/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.34 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5927084 | 0.92 | KIFC1 (0.41) | LRRK2NPC1RAB9AITGA4ITGB1 | |
| SCHEMBL5927080 | 0.92 | KIFC1 (0.41) | LRRK2NPC1RAB9AITGA4ITGB1 | |
| SCHEMBL5927392 | 0.91 | ABCG2 (0.43) | LRRK2LMNAPOLBNPSR1ITGA4 | |
| SCHEMBL5927387 | 0.91 | ABCG2 (0.43) | LRRK2LMNAPOLBNPSR1ITGA4 | |
| SCHEMBL8337501 | 0.88 | LRRK2 (0.47) | LRRK2LMNAPOLBNPSR1ABCG2 | |
| SCHEMBL8337386 | 0.88 | LRRK2 (0.49) | LRRK2LMNAPOLBNPSR1ABCG2 | |
| SCHEMBL8337545 | 0.86 | LRRK2 (0.38) | LRRK2LMNAPOLBNPSR1ITGA4 | |
| SCHEMBL8337399 | 0.85 | LRRK2 (0.49) | LRRK2POLBITGA4ITGB1ABCG2 | |
| SCHEMBL8337866 | 0.85 | PTPN11 (0.44) | LRRK2LMNAPOLBNPSR1ITGA4 | |
| SCHEMBL8337880 | 0.83 | ITGA4 (0.39) | LRRK2LMNAPOLBNPSR1ITGA4 |
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-2004014844-A2 | ARYL AND HETEROARYL COMPOUNDS AND METHODS TO MODULATE COAGULATION | TRANSTECH PHARMA, INC. (US) | 2004-02-19 | — | — | WO | disclosed |