Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.44 |
| ▸ | FEN1 | P39748 | 1/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.41 |
| ▸ | DCLRE1A | Q6PJP8 | 1/20 | 0.41 |
| ▸ | DCLRE1B | Q9H816 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.37 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ACLY | P53396 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6308178 | 0.83 | ESR2 (0.53) | ESR2CYP1A2ERCC5FEN1AHR | |
| SCHEMBL27767819 | 0.83 | DCLRE1A (0.43) | ESR2CYP1A2DCLRE1ADCLRE1BSMN1; SMN2 | |
| SCHEMBL455298 | 0.82 | ESR2 (0.47) | ESR2CYP1A2ERCC5FEN1AHR | |
| SCHEMBL6772798 | 0.82 | ESR2 (0.47) | ESR2CYP1A2ERCC5FEN1AHR | |
| Biphenyl SCHEMBL11221029 | 0.80 | TAAR1 (0.52) | CYP1A2SMN1; SMN2HIF1ATAAR1ALDH1A1 | |
| SCHEMBL28792711 | 0.79 | MEN1 (0.42) | ESR2CYP1A2DCLRE1ADCLRE1BSMN1; SMN2 | |
| SCHEMBL27471595 | 0.78 | ACLY (0.44) | ESR2CYP1A2DCLRE1ADCLRE1BBACE1 | |
| SCHEMBL2139060 | 0.78 | HPGD (0.42) | ESR2CYP1A2DCLRE1ADCLRE1BBACE1 | |
| SCHEMBL27489870 | 0.77 | ERCC5 (0.43) | ESR2CYP1A2ERCC5FEN1AHR | |
| SCHEMBL29493845 | 0.75 | AHR (0.74) | ESR2CYP1A2ERCC5FEN1AHR |
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-101270120-A | Novel tricyclic derivatives, method for preparing same and pharmaceutical compositions containing same | SERVIER LAB (FR) | 2008-09-24 | — | — | CN | disclosed |