Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 19/20 | 0.58 |
| ▸ | PMAIP1 | Q13794 | 6/20 | 0.47 |
| ▸ | ALB | P02768 | 1/20 | 0.47 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | BAD | Q92934 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19635293 | 0.95 | MCL1 (0.53) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL19615795 | 0.94 | MCL1 (0.52) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL29602109 | 0.94 | MCL1 (0.52) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| SCHEMBL19635283 | 0.90 | MCL1 (0.57) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| SCHEMBL19635480 | 0.90 | MCL1 (0.60) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL29601770 | 0.90 | MCL1 (0.59) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL19615290 | 0.90 | MCL1 (0.59) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL21802185 | 0.87 | MCL1 (0.52) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| Hydrochloric Acid SCHEMBL29602270 | 0.87 | MCL1 (0.52) | MCL1PMAIP1ALBBCL2BCL2L1 | |
| SCHEMBL19635310 | 0.87 | MCL1 (0.55) | MCL1PMAIP1ALBBCL2 |
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 |