Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | HASPIN | Q8TF76 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | STAT6 | P42226 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20135936 | 0.84 | PLA2G4A (0.49) | MAOAMAOBHASPINTP53ACHE | |
| SCHEMBL20135941 | 0.81 | MAOA (0.53) | MAOAMAOBHASPINTP53CYP1A2 | |
| SCHEMBL20135929 | 0.79 | MAOA (0.51) | MAOAMAOBHASPINTP53CYP1A2 | |
| SCHEMBL20135898 | 0.78 | MAOA (0.55) | MAOAMAOBHASPINKMT2AMAPT | |
| SCHEMBL20147188 | 0.77 | MAOA (0.54) | MAOAMAOBHASPINCYP1A2CYP3A4 | |
| SCHEMBL20135922 | 0.74 | MAOA (0.47) | MAOAMAOBHASPINTP53CYP1A2 | |
| SCHEMBL20135935 | 0.74 | MAOA (0.51) | MAOAMAOBHASPINTP53CYP1A2 | |
| SCHEMBL27351040 | 0.74 | MAOA (0.51) | MAOAMAOBHASPINTP53CYP1A2 | |
| SCHEMBL27350987 | 0.73 | MAOA (0.50) | MAOAMAOBHASPINTP53CYP1A2 | |
| SCHEMBL27348493 | 0.72 | MAOA (0.48) | MAOAMAOBHASPINTP53CYP1A2 |
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-2018087389-A1 | SELECTIVE INHIBITORS OF GENOTOXIC STRESS-INDUCED IKK/NF-kB PATHWAYS | MAX-DELBRÜCK-CENTRUM FÜR MOLEKULARE MEDIZIN IN DER HELMHOLTZ-GEMEINSCHAFT (DE) | 2018-05-17 | — | — | WO | disclosed |