Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 5/20 | 0.39 |
| ▸ | DRD2 | P14416 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20765618 | 1.00 | ALDH1A1 (0.40) | ALDH1A1MAPTDRD3DRD2MEN1 | |
| SCHEMBL20765519 | 0.87 | MEN1 (0.38) | ALDH1A1MEN1KMT2A | |
| SCHEMBL20765521 | 0.87 | MEN1 (0.38) | ALDH1A1MEN1KMT2A | |
| SCHEMBL20765600 | 0.87 | CHEK2 (0.42) | ALDH1A1DRD3DRD2POLB | |
| SCHEMBL20765598 | 0.87 | CHEK2 (0.42) | ALDH1A1DRD3DRD2POLB | |
| SCHEMBL20765465 | 0.83 | IDH1 (0.37) | ALDH1A1MEN1KMT2A | |
| SCHEMBL20765462 | 0.83 | IDH1 (0.37) | ALDH1A1MEN1KMT2A | |
| SCHEMBL20765463 | 0.81 | GRIN1 (0.41) | ALDH1A1MAPK1 | |
| SCHEMBL20765464 | 0.81 | GRIN1 (0.41) | ALDH1A1MAPK1 | |
| SCHEMBL20765470 | 0.80 | BCHE (0.39) | ALDH1A1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |