Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4222683 | 0.82 | CHRNA7 (0.62) | KDM4EGFERADRA2AADRA2BADRA2C | |
| SCHEMBL1100438 | 0.80 | ALDH1A1 (0.72) | ALDH1A1KDM4EGFERL3MBTL1ADRA2A | |
| SCHEMBL27581509 | 0.79 | DRD2 (0.65) | KDM4ECHRNA7DRD2SIGMAR1KCNH2 | |
| SCHEMBL4577581 | 0.79 | KDM4E (0.50) | ALDH1A1KDM4EGFERL3MBTL1ESR1 | |
| SCHEMBL282701 | 0.76 | ADRA2C (0.50) | ALDH1A1KDM4EGFERADRA2CKMT2A | |
| SCHEMBL29005764 | 0.76 | KCNH2 (0.45) | ADRA2AADRA2BADRA2CMEN1KMT2A | |
| SCHEMBL4575709 | 0.76 | DRD2 (0.44) | MEN1KMT2ACHRNA7DRD2SIGMAR1 | |
| SCHEMBL1443053 | 0.76 | LMNA (0.47) | ALDH1A1L3MBTL1MEN1KMT2ACHRNA7 | |
| SCHEMBL4233743 | 0.75 | DRD4 (0.70) | ALDH1A1KDM4EDRD2SIGMAR1MAPT | |
| SCHEMBL7643296 | 0.74 | MAPT (0.51) | ALDH1A1GFERMEN1KMT2APOLB |
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 |