Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.46 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.46 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.46 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30730521 | 1.00 | ERN1 (0.55) | ERN1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL30730415 | 0.95 | ERN1 (0.56) | ERN1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL29149106 | 0.95 | ERN1 (0.56) | ERN1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL29149135 | 0.82 | LCK (0.69) | CYP1B1MAOBLCKKDM4EALDH1A1 | |
| SCHEMBL11672123 | 0.81 | CALCRL (0.67) | ERN1CALCRLCYP1A1CYP1B1ALOX5 | |
| SCHEMBL30730455 | 0.80 | ERN1 (0.60) | ERN1CALCRLCYP1A1CYP1B1ALOX5 | |
| SCHEMBL29149118 | 0.80 | ERN1 (0.60) | ERN1CALCRLCYP1A1CYP1B1ALOX5 | |
| SCHEMBL30730472 | 0.78 | ALOX5 (0.60) | ERN1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL29149162 | 0.78 | ALOX5 (0.60) | ERN1CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL11672469 | 0.78 | ABCB1 (0.65) | ERN1CYP1A1CYP1B1ALOX5PTGES |
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-117447402-A | Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof | 德明药泰生物技术（深圳）有限公司 | 2024-01-26 | — | — | CN | disclosed |