Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 5/20 | 0.77 |
| ▸ | BCL2L1 | Q07817 | 5/20 | 0.77 |
| ▸ | BCL2 | P10415 | 4/20 | 0.77 |
| ▸ | BCL2L2 | Q92843 | 2/20 | 0.77 |
| ▸ | AKR1B1 | P15121 | 10/20 | 0.52 |
| ▸ | ALB | P02768 | 3/20 | 0.43 |
| ▸ | LDHA | P00338 | 3/20 | 0.42 |
| ▸ | LDHB | P07195 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30143506 | 1.00 | MCL1 (0.77) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| SCHEMBL30143382 | 0.96 | MCL1 (0.69) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| Apogossypol SCHEMBL29467534 | 0.88 | BCL2L1 (1.00) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| Apogossypol SCHEMBL2513478 | 0.88 | BCL2L1 (1.00) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| Apogossypol SCHEMBL29353524 | 0.88 | BCL2L1 (1.00) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| SCHEMBL12200184 | 0.85 | BCL2L1 (0.93) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| SCHEMBL29740136 | 0.82 | MCL1 (0.58) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| SCHEMBL2622274 | 0.82 | MCL1 (0.58) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| SCHEMBL14958609 | 0.82 | MCL1 (0.87) | MCL1BCL2L1BCL2BCL2L2AKR1B1 | |
| SCHEMBL30143404 | 0.79 | MCL1 (0.66) | MCL1BCL2L1BCL2BCL2L2AKR1B1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8445441-B2 | Inhibitors of BCL-2 | CASE WESTERN RESERVE UNIVERSITY (US) | 2013-05-21 | — | — | US | disclosed |