Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 17/20 | 0.77 |
| ▸ | HKDC1 | Q2TB90 | 6/20 | 0.77 |
| ▸ | KEAP1 | Q14145 | 6/20 | 0.77 |
| ▸ | NFE2L2 | Q16236 | 6/20 | 0.77 |
| ▸ | HK1 | P19367 | 3/20 | 0.77 |
| ▸ | BCL2 | P10415 | 5/20 | 0.72 |
| ▸ | BCL2L1 | Q07817 | 5/20 | 0.72 |
| ▸ | BCL2A1 | Q16548 | 5/20 | 0.72 |
| ▸ | BCL2L2 | Q92843 | 5/20 | 0.72 |
| ▸ | MEN1 | O00255 | 4/20 | 0.62 |
| ▸ | POLB | P06746 | 4/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.62 |
| ▸ | BLM | P54132 | 3/20 | 0.62 |
| ▸ | CFTR | P13569 | 3/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.62 |
| ▸ | GOPC | Q9HD26 | 3/20 | 0.62 |
| ▸ | TDP2 | O95551 | 3/20 | 0.62 |
| ▸ | NSD2 | O96028 | 3/20 | 0.62 |
| ▸ | G6PD | P11413 | 3/20 | 0.62 |
| ▸ | EP300 | Q09472 | 2/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL18210700 | 0.92 | MCL1 (0.70) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL18210712 | 0.92 | MCL1 (0.74) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL18210702 | 0.91 | MCL1 (0.84) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL18210695 | 0.91 | MCL1 (0.68) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL14851475 | 0.91 | MCL1 (0.94) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL18210699 | 0.90 | MCL1 (0.83) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL18210696 | 0.87 | MCL1 (0.64) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL14851295 | 0.87 | MCL1 (1.00) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL18210685 | 0.87 | MCL1 (0.69) | MCL1HKDC1KEAP1NFE2L2HK1 | |
| SCHEMBL14851310 | 0.87 | HKDC1 (0.80) | MCL1HKDC1KEAP1NFE2L2HK1 |
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-9486422-B2 | Small molecule inhibitors of Mcl-1 and the uses of thereof | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2016-11-08 | — | — | US | disclosed |