Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20782579 | 0.92 | ALDH1A1 (0.55) | HPGDMGLLKDM4EALDH1A1GAA | |
| SCHEMBL20765467 | 0.85 | ALDH1A1 (0.52) | HPGDMGLLKDM4EALDH1A1GAA | |
| SCHEMBL20765715 | 0.84 | ALDH1A1 (0.56) | HPGDMGLLKDM4EALDH1A1GAA | |
| SCHEMBL20765497 | 0.84 | MGLL (0.58) | HPGDMGLLKDM4EALDH1A1MEN1 | |
| SCHEMBL20765580 | 0.83 | KDM4E (0.50) | HPGDKDM4EALDH1A1MEN1LMNA | |
| SCHEMBL20765518 | 0.82 | KDM4E (0.47) | HPGDMGLLKDM4EALDH1A1MEN1 | |
| SCHEMBL20765510 | 0.82 | ALDH1A1 (0.48) | HPGDKDM4EALDH1A1GAAMEN1 | |
| SCHEMBL20765528 | 0.81 | ALDH1A1 (0.50) | HPGDMGLLKDM4EALDH1A1GAA | |
| SCHEMBL20765547 | 0.81 | MAPK14 (0.55) | HPGDMGLLKDM4EALDH1A1MEN1 | |
| SCHEMBL20774945 | 0.81 | MAPK14 (0.55) | HPGDMGLLALDH1A1MEN1LMNA |
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 |