Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 19/20 | 0.48 |
| ▸ | ALB | P02768 | 2/20 | 0.45 |
| ▸ | PMAIP1 | Q13794 | 4/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.40 |
| ▸ | BAD | Q92934 | 2/20 | 0.40 |
| ▸ | EEF2K | O00418 | 2/20 | 0.40 |
| ▸ | MARK3 | P27448 | 2/20 | 0.40 |
| ▸ | AXL | P30530 | 2/20 | 0.40 |
| ▸ | NEK4 | P51957 | 2/20 | 0.40 |
| ▸ | CAMK2B | Q13554 | 2/20 | 0.40 |
| ▸ | CAMK2G | Q13555 | 2/20 | 0.40 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.40 |
| ▸ | MARK2 | Q7KZI7 | 2/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.40 |
| ▸ | HIPK2 | Q9H2X6 | 2/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.40 |
| ▸ | MAP3K20 | Q9NYL2 | 2/20 | 0.40 |
| ▸ | CDC7 | O00311 | 1/20 | 0.40 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19635693 | 0.88 | MCL1 (0.54) | MCL1ALBPMAIP1BCL2L1BAD | |
| Hydrochloric Acid SCHEMBL21802176 | 0.87 | MCL1 (0.53) | MCL1ALBPMAIP1BCL2L1BAD | |
| Hydrochloric Acid SCHEMBL29601802 | 0.87 | MCL1 (0.53) | MCL1ALBPMAIP1BCL2L1BAD | |
| SCHEMBL19635333 | 0.86 | MCL1 (0.48) | MCL1ALBPMAIP1BCL2L1BAD | |
| SCHEMBL19635432 | 0.84 | MCL1 (0.49) | MCL1ALBPMAIP1BCL2L1BAD | |
| SCHEMBL19635841 | 0.83 | MCL1 (0.47) | MCL1ALBPMAIP1BCL2L1BAD | |
| SCHEMBL23251278 | 0.83 | MCL1 (0.55) | MCL1ALBPMAIP1BCL2L1BAD | |
| SCHEMBL24378230 | 0.82 | MCL1 (0.56) | MCL1ALBPMAIP1BCL2L1BAD | |
| SCHEMBL23111364 | 0.81 | MCL1 (0.51) | MCL1ALBPMAIP1BAD | |
| SCHEMBL24594111 | 0.80 | MCL1 (0.40) | MCL1PMAIP1BCL2L1BAD |
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-2017198341-A1 | MACROCYCLIC INDOLE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 2017-11-23 | — | — | WO | disclosed |