Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.50 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.50 |
| ▸ | FEN1 | P39748 | 1/20 | 0.50 |
| ▸ | KMO | O15229 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.44 |
| ▸ | ATR | Q13535 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4970235 | 0.81 | KMO (0.51) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL2308639 | 0.80 | KMO (0.44) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL2448219 | 0.80 | KMO (0.44) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL3242203 | 0.80 | KMO (0.44) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL2406803 | 0.78 | ALOX5AP (0.48) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL28513229 | 0.77 | CYP1A2 (0.61) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL28008349 | 0.75 | NOTUM (0.44) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL2448730 | 0.73 | ACP1 (0.44) | CYP1A2CYP3A4ALOX5APFEN1KMO | |
| SCHEMBL14529195 | 0.73 | ACP1 (0.64) | CYP1A2CYP3A4KMOCYP2C19TSHR | |
| SCHEMBL15332431 | 0.73 | CYP1A2 (0.50) | CYP1A2CYP3A4ALOX5APFEN1KMO |
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 |
|---|---|---|---|---|---|---|---|
| CN-102884063-B | Can be used as the azabicyclo imdazole derivatives of the replacement of TRPM8 receptor modulators | JANSSEN PHARMACEUTICA N.V. (BE) | 2015-11-25 | — | — | CN | disclosed |