Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.56 |
| ▸ | BCHE | P06276 | 2/20 | 0.51 |
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | CHEK2 | O96017 | 7/20 | 0.49 |
| ▸ | ACACB | O00763 | 2/20 | 0.47 |
| ▸ | ACACA | Q13085 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765497 | 0.87 | MGLL (0.58) | MGLLBCHEACHECHEK2ACACB | |
| SCHEMBL20765786 | 0.83 | BCHE (0.55) | MGLLBCHEACHECHEK2ACACB | |
| SCHEMBL20765523 | 0.82 | MGLL (0.58) | MGLLBCHEACHECHEK2ACACB | |
| SCHEMBL20765616 | 0.81 | KDM4E (0.52) | MGLLBCHEACHECHEK2HDAC6 | |
| SCHEMBL20765511 | 0.79 | ACACB (0.59) | MGLLACACBHPGD | |
| SCHEMBL20765715 | 0.79 | ALDH1A1 (0.56) | MGLLCHEK2HPGDMAPK14 | |
| SCHEMBL20782579 | 0.79 | ALDH1A1 (0.55) | MGLLBCHEACHEHPGDMAPK14 | |
| SCHEMBL19970807 | 0.79 | ACACB (0.62) | MGLLBCHEACHECHEK2ACACB | |
| SCHEMBL21843704 | 0.79 | HPGD (0.70) | MGLLCHEK2ACACBACACAHDAC6 | |
| SCHEMBL16619560 | 0.78 | MGLL (0.65) | MGLLCHEK2ACACBACACAHDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019038683-A1 | COMPOUNDS TARGETING TANDEM BRCT DOMAINS OF BRCA1, COMPOSITIONS AND METHODS THEREOF | INSTITUTE FOR STEM CELL BIOLOGY AND REGENERATIVE MEDICINE (IN) | 2019-02-28 | — | — | WO | claimed |
| WO-2019038683-A1 | COMPOUNDS TARGETING TANDEM BRCT DOMAINS OF BRCA1, COMPOSITIONS AND METHODS THEREOF | INSTITUTE FOR STEM CELL BIOLOGY AND REGENERATIVE MEDICINE (IN) | 2019-02-28 | — | — | WO | disclosed |