Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 8/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.38 |
| ▸ | BACE1 | P56817 | 2/20 | 0.38 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL22207663 | 0.91 | ABCB1 (0.51) | GPR119ABCB1P2RX7MCL1 | |
| SCHEMBL9067588 | 0.91 | ABCB1 (0.51) | GPR119ABCB1P2RX7MCL1 | |
| SCHEMBL21996502 | 0.91 | ABCB1 (0.51) | GPR119ABCB1P2RX7MCL1 | |
| SCHEMBL21996529 | 0.89 | ABCB1 (0.40) | GPR119ABCB1MCL1MEN1KMT2A | |
| SCHEMBL22324645 | 0.87 | ABCB1 (0.43) | GPR119ABCB1BACE1BACE2 | |
| SCHEMBL12460552 | 0.86 | HSD11B1 (0.40) | GPR119ABCB1MCL1MEN1KMT2A | |
| SCHEMBL1366650 | 0.83 | CYP2D6 (0.42) | GPR119MCL1MEN1KMT2A | |
| SCHEMBL1366652 | 0.83 | CYP2D6 (0.42) | GPR119MCL1MEN1KMT2A | |
| SCHEMBL29765023 | 0.83 | CYP2D6 (0.42) | GPR119MCL1MEN1KMT2A | |
| SCHEMBL29105266 | 0.83 | CYP2D6 (0.42) | GPR119MCL1MEN1KMT2A |
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-2020113077-A1 | COMPOSITIONS AND METHODS FOR MODULAR CONTROL OF BIOORTHOGONAL LIGATION | THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) | 2020-06-04 | — | — | WO | disclosed |