Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.37 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.36 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24200436 | 0.83 | KDM4E (0.40) | AHRALDH1A1IMPDH2HDAC3HDAC4 | |
| SCHEMBL27979729 | 0.83 | ALDH1A1 (0.47) | AHRALDH1A1GPR3ALKBH5FTO | |
| SCHEMBL24200425 | 0.80 | ALKBH5 (0.41) | AHRALDH1A1IMPDH2GPR3ALKBH5 | |
| SCHEMBL29925076 | 0.79 | AHR (0.47) | AHRALDH1A1IMPDH2GPR3ALKBH5 | |
| SCHEMBL27979863 | 0.79 | AHR (0.47) | AHRALDH1A1IMPDH2GPR3ALKBH5 | |
| SCHEMBL28540135 | 0.75 | AHR (0.44) | AHRALDH1A1IMPDH2GPR3ALKBH5 | |
| SCHEMBL9779016 | 0.72 | AHR (0.51) | AHRALDH1A1IMPDH2GPR3ALKBH5 | |
| SCHEMBL27979867 | 0.71 | PGR (0.43) | ALDH1A1KDM4ELMNAGAAKMT2A | |
| SCHEMBL6710234 | 0.70 | ALDH1A1 (0.46) | ALDH1A1IMPDH2L3MBTL1TDP1KDM4E | |
| SCHEMBL28839834 | 0.68 | PTGER4 (0.47) | ALDH1A1TDP1KDM4ELMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3321264-A1 | SELECTIVE INHIBITORS OF GENOTOXIC STRESS-INDUCED IKK/NF-KB PATHWAYS | Max-Delbrück-Centrum für Molekulare Medizin in der Helmholtz-Gemeinschaft (DE) | 2018-05-16 | — | — | EP | disclosed |