Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 5/20 | 0.37 |
| ▸ | CAMK1D | Q8IU85 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16599760 | 0.85 | ADRB1 (0.43) | BTKACVR1MAPK10 | |
| SCHEMBL30798658 | 0.82 | ACVR1 (0.45) | ACVR1PARP1ALDH1A1LMNA | |
| SCHEMBL25366356 | 0.72 | HTR6 (0.44) | ACVR1HTR7HTR6 | |
| SCHEMBL3883327 | 0.71 | SMARCA2 (0.42) | ACVR1HTR1AHTR7HTR6ALDH1A1 | |
| SCHEMBL30311470 | 0.70 | ALB (0.47) | HRH4HTR3AALDH1A1LMNAHPGD | |
| SCHEMBL6262440 | 0.70 | RXFP1 (0.42) | BTKACVR1HTR7MAPKAPK2MAPK14 | |
| SCHEMBL15059858 | 0.69 | NPC1 (0.55) | PARP1ALDH1A1JAK2HPGD | |
| SCHEMBL18641223 | 0.68 | PRKCA (0.46) | ACVR1PARP1HTR7SLC6A4ALDH1A1 | |
| SCHEMBL746343 | 0.68 | ALDH1A1 (0.54) | HTR1AHTR7HTR2BHTR3AHTR6 | |
| SCHEMBL3633976 | 0.68 | ACVR1 (0.62) | ACVR1PARP1HTR1AHTR7HTR2B |
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-2015048306-A1 | NOVEL AGENTS TARGETING CYP51 | THE SCRIPPS RESEARCH INSTITUTE (US) | 2015-04-02 | — | — | WO | disclosed |