Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | DDB1 | Q16531 | 3/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 3/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | LIPE | Q05469 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | PREP | P48147 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22056023 | 1.00 | NR1H2 (0.39) | NR1H2DDB1CRBNRORCUSP2 | |
| SCHEMBL1007010 | 0.86 | DDB1 (0.40) | NR1H2DDB1CRBNRORCUSP2 | |
| SCHEMBL1006353 | 0.86 | KDM4E (0.43) | USP2SMN1; SMN2MAPTKDM4ETHRB | |
| SCHEMBL24812373 | 0.83 | NR1H2 (0.42) | NR1H2DDB1CRBNRORCUSP2 | |
| SCHEMBL27736427 | 0.83 | NR1H2 (0.42) | NR1H2DDB1CRBNUSP2SMN1; SMN2 | |
| SCHEMBL2732408 | 0.81 | PDE4B (0.43) | NR1H2DDB1CRBNUSP2SMN1; SMN2 | |
| SCHEMBL28422335 | 0.79 | DDB1 (0.41) | NR1H2DDB1CRBNUSP2SMN1; SMN2 | |
| SCHEMBL23580148 | 0.79 | NR1H2 (0.41) | NR1H2DDB1CRBNRORCUSP2 | |
| SCHEMBL954970 | 0.78 | NR1H2 (0.43) | NR1H2DDB1CRBNRORCUSP2 | |
| SCHEMBL12364068 | 0.78 | NR1H2 (0.40) | NR1H2DDB1CRBNRORCUSP2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3887371-A1 | ARYL COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF BACTERIAL INFECTION | F. Hoffmann-La Roche AG (CH) | 2021-10-06 | — | — | EP | disclosed |
| WO-2020109191-A1 | ARYL COMPOUNDS FOR THE TREATMENT AND PROPHYLAXIS OF BACTERIAL INFECTION | F. HOFFMANN-LA ROCHE AG (CH) | 2020-06-04 | — | — | WO | disclosed |