Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 7/20 | 0.46 |
| ▸ | DHODH | Q02127 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.40 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816596 | 0.88 | ACHE (0.48) | ACHEDHODHPARP1ADORA2AADORA1 | |
| SCHEMBL8891808 | 0.86 | ACHE (0.43) | ACHEDHODHPARP1LTA4HPTGS2 | |
| SCHEMBL8891268 | 0.86 | ACHE (0.43) | ACHEDHODHPARP1LTA4HPTGS2 | |
| SCHEMBL8892025 | 0.85 | ACHE (0.42) | ACHEDHODHPARP1LTA4HPTGS2 | |
| SCHEMBL8816922 | 0.84 | ACHE (0.43) | ACHEADORA2AADORA1ADORA3ADORA2B | |
| SCHEMBL8816636 | 0.84 | ACHE (0.39) | ACHECHEK2PRMT5 | |
| SCHEMBL8814977 | 0.82 | ACHE (0.46) | ACHEDHODHLTA4HADORA2AADORA1 | |
| SCHEMBL8084233 | 0.82 | DHODH (0.42) | ACHEDHODHPARP1CHEK2 | |
| SCHEMBL8816985 | 0.81 | ACHE (0.52) | ACHEDHODHPARP1LTA4HADORA2A | |
| SCHEMBL8817000 | 0.80 | PRMT5 (0.34) | DHODHPARP1PRMT5 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000506529-A | — | — | 2000-05-30 | — | — | JP | claimed |
| WO-1997033873-A1 | METHODS OF TREATING OR PREVENTING INTERSTITIAL CYSTITIS | ELI LILLY AND COMPANY (US) | 1997-09-18 | — | — | WO | claimed |