Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.41 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 8/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 7/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 7/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL29229137 | 0.80 | HTR1A (0.46) | HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL363270 | 0.76 | PDK2 (0.47) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2642390 | 0.74 | PDK2 (0.46) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2460605 | 0.74 | HCAR2 (0.48) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL32162354 | 0.74 | HCAR2 (0.48) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL25400549 | 0.74 | PDK2 (0.46) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL934667 | 0.74 | PDK2 (0.46) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2643737 | 0.74 | PDK2 (0.46) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2642386 | 0.74 | PDK2 (0.46) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL15354765 | 0.74 | PDK2 (0.46) | PDK2HTR1ASLC6A2SLC6A4SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023122093-A1 | REV-ERB AGONISTS FOR TH17-MEDIATED INFLAMMATORY DISORDERS | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2023-06-29 | — | — | WO | disclosed |
| CN-104918934-A | 3-substituted pyrazoles and their use as DLK inhibitors | HOFFMANN LA ROCHE | 2015-09-16 | — | — | CN | disclosed |