Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 15/20 | 0.48 |
| ▸ | ALB | P02768 | 2/20 | 0.48 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | EEF2K | O00418 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | MARK3 | P27448 | 1/20 | 0.36 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | AKT2 | P31751 | 1/20 | 0.36 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.36 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.36 |
| ▸ | NEK2 | P51955 | 1/20 | 0.36 |
| ▸ | NEK4 | P51957 | 1/20 | 0.36 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29602389 | 0.83 | MCL1 (0.40) | MCL1ALBBCL2BCL2L1CYP1A2 | |
| SCHEMBL29602103 | 0.80 | MCL1 (0.65) | MCL1ALBBCL2BCL2L1PMAIP1 | |
| SCHEMBL19615109 | 0.80 | MCL1 (0.65) | MCL1ALBBCL2BCL2L1PMAIP1 | |
| SCHEMBL19635604 | 0.78 | MCL1 (0.56) | MCL1ALBBCL2BCL2L1PMAIP1 | |
| SCHEMBL29602033 | 0.78 | MCL1 (0.56) | MCL1ALBBCL2BCL2L1PMAIP1 | |
| SCHEMBL29602384 | 0.75 | HRH3 (0.40) | MCL1ALBBCL2BCL2L1MEN1 | |
| SCHEMBL29601844 | 0.72 | MCL1 (0.36) | MCL1BCL2BCL2L1 | |
| SCHEMBL19615275 | 0.65 | MCL1 (0.60) | MCL1ALBBCL2BCL2L1PMAIP1 | |
| SCHEMBL4170698 | 0.65 | MCL1 (1.00) | MCL1ALBBCL2BCL2L1CDC7 | |
| SCHEMBL4165617 | 0.64 | MCL1 (0.79) | MCL1ALBBCL2BCL2L1CDC7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3458459-B1 | MACROCYCLIC INDOLE DERIVATIVES | BAYER AG (DE) | 2022-04-27 | — | — | EP | claimed |