Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | UGCG | Q16739 | 1/20 | 0.41 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.41 |
| ▸ | AGXT | P21549 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 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 | |
|---|---|---|---|---|
| SCHEMBL6507918 | 0.85 | ESR1 (0.48) | ESR1TDP1L3MBTL1GBA1UGCG | |
| SCHEMBL6506706 | 0.83 | L3MBTL1 (0.61) | ESR1TDP1L3MBTL1GBA1UGCG | |
| SCHEMBL6508614 | 0.82 | ESR1 (0.42) | ESR1TDP1L3MBTL1GBA1UGCG | |
| SCHEMBL28451813 | 0.80 | AGXT (0.45) | ESR1KCNH2TDP1L3MBTL1GBA1 | |
| SCHEMBL19837706 | 0.80 | AGXT (0.45) | ESR1KCNH2TDP1L3MBTL1GBA1 | |
| SCHEMBL6509740 | 0.80 | ESR1 (0.43) | ESR1TDP1L3MBTL1ADRB2 | |
| SCHEMBL6530577 | 0.80 | ESR1 (0.40) | ESR1TDP1L3MBTL1 | |
| SCHEMBL430043 | 0.79 | ESR1 (0.62) | ESR1KCNH2TDP1L3MBTL1AGXT | |
| SCHEMBL986310 | 0.79 | ESR1 (0.61) | ESR1TDP1AGXTCA1CA2 | |
| SCHEMBL6512248 | 0.79 | GBA1 (0.49) | KCNH2TDP1L3MBTL1GBA1UGCG |
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-2005100329-A1 | NOVEL PROTECTING REAGENTS, PROTECTING GROUPS AND METHODS OF FORMING AND USING THE SAME | THE UNIVERSITY OF MISSISSIPI (US) | 2005-10-27 | — | — | WO | disclosed |