Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | AGXT | P21549 | 2/20 | 0.38 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | FAAH | O00519 | 2/20 | 0.38 |
| ▸ | MGLL | Q99685 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL27961596 | 0.86 | ALDH1A1 (0.41) | LMNAGAAL3MBTL1SMN1; SMN2MAPT | |
| Ethoxycarbonyl Group SCHEMBL27558742 | 0.84 | DHODH (0.40) | TAAR1LMNAGAAL3MBTL1SMN1; SMN2 | |
| Ethoxycarbonyl Group SCHEMBL27687097 | 0.83 | TSHR (0.42) | TAAR1IDO1AGXTABCC4LMNA | |
| Tert-Butyl Formate SCHEMBL28035122 | 0.80 | TDP1 (0.43) | TAAR1IDO1AGXTABCC4LMNA | |
| SCHEMBL1071609 | 0.78 | TAAR1 (0.56) | TAAR1IDO1AGXTABCC4LMNA | |
| Aniline SCHEMBL27426850 | 0.77 | CYP3A4 (0.45) | TAAR1IDO1AGXTLMNATSHR | |
| Water SCHEMBL28351968 | 0.75 | TAAR1 (0.54) | TAAR1IDO1AGXTABCC4LMNA | |
| Hydrochloric Acid SCHEMBL28118118 | 0.75 | TAAR1 (0.54) | TAAR1IDO1AGXTABCC4LMNA | |
| SCHEMBL131472 | 0.74 | IDO1 (0.55) | TAAR1IDO1AGXTABCC4LMNA | |
| Chlorobenzene SCHEMBL28088147 | 0.74 | TSHR (0.46) | LMNATSHRL3MBTL1SMN1; SMN2MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105330541-B | The synthetic method of the alkyl formate of 4 ' halogenated methyl biphenyl 2 | 常州博世伟业生物科技有限公司 | 2017-09-12 | — | — | CN | disclosed |
| CN-105330541-A | Synthesis method of 4'-halogenated methylbiphenyl-2-formic aid alkyl ester | CHANGZHOU BOSHI WEIYE BIOTECHNOLOGY CO LTD | 2016-02-17 | — | — | CN | disclosed |