Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 5/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ENPP1 | P22413 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 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 | |
|---|---|---|---|---|
| SCHEMBL9493152 | 0.89 | NR4A2 (0.46) | CRHR1L3MBTL1CCR1CCR8CYP3A4 | |
| SCHEMBL9492503 | 0.84 | CYP3A4 (0.40) | CRHR1L3MBTL1CCR1CCR8CYP3A4 | |
| SCHEMBL9492598 | 0.83 | ELANE (0.44) | CRHR1L3MBTL1CYP3A4TSHRMAPT | |
| SCHEMBL21144535 | 0.83 | MAPT (0.39) | L3MBTL1CCR1CCR8CYP3A4TSHR | |
| SCHEMBL9493489 | 0.81 | ALDH1A1 (0.43) | L3MBTL1CYP3A4TSHRCYP1A2PARP1 | |
| SCHEMBL10506369 | 0.81 | CYP3A4 (0.38) | CRHR1L3MBTL1CCR1CCR8CYP3A4 | |
| SCHEMBL9493850 | 0.80 | LMNA (0.38) | CRHR1L3MBTL1CCR1CCR8CYP3A4 | |
| SCHEMBL10824099 | 0.80 | CYP3A4 (0.37) | CRHR1L3MBTL1CCR1CCR8CYP3A4 | |
| SCHEMBL9494545 | 0.79 | NQO2 (0.48) | MAPTPARP1ALDH1A1KDM4EMEN1 | |
| SCHEMBL2710931 | 0.76 | NT5E (0.48) | L3MBTL1CCR1CCR8ENPP1CYP1A2 |
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-0113432-A1 | Chloromethyl quinoline derivatives, process for their preparation and their use | ALKALOIDA VEGYéSZETI GYáR (HU) | 1984-07-18 | — | — | EP | claimed |