Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 10/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.36 |
| ▸ | CSF1R | P07333 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28756772 | 0.88 | HDAC1 (0.38) | HDAC1HDAC6BRD4 | |
| SCHEMBL20605093 | 0.79 | MCL1 (0.42) | HDAC1HDAC6MCL1 | |
| SCHEMBL28756706 | 0.78 | AR (0.36) | — | |
| SCHEMBL28756665 | 0.75 | CYP11B1 (0.39) | ALOX5AP | |
| SCHEMBL26581654 | 0.70 | MCL1 (0.49) | BRD4MCL1 | |
| SCHEMBL30587555 | 0.69 | KLKB1 (0.40) | HDAC1KLKB1BRD4TGFBR1 | |
| SCHEMBL23800108 | 0.69 | MCL1 (0.47) | HDAC1HDAC6MCL1 | |
| SCHEMBL23809241 | 0.68 | MCL1 (0.46) | HDAC1HDAC6MCL1 | |
| SCHEMBL20604902 | 0.67 | GRIN2B (0.42) | HDAC1HDAC6BRD4MCL1 | |
| SCHEMBL20604968 | 0.62 | HDAC1 (0.40) | HDAC1HDAC6KLKB1CSF1RBRD4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109153643-B | Substituted indole MCL-1 inhibitors | 范德比尔特大学 | 2022-06-21 | — | — | CN | disclosed |
| EP-3423435-A1 | SUBSTITUTED INDOLE MCL-1 INHIBITORS | Vanderbilt University (US) | 2019-01-09 | — | — | EP | disclosed |