Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | BID | P55957 | 1/20 | 0.31 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.31 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.31 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7562175 | 1.00 | TAAR1 (0.52) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL8076079 | 1.00 | TAAR1 (0.52) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL8076540 | 1.00 | TAAR1 (0.52) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL7560863 | 1.00 | TAAR1 (0.52) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL7561614 | 1.00 | TAAR1 (0.52) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL7561943 | 0.98 | TAAR1 (0.54) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL7560713 | 0.91 | TAAR1 (0.56) | TAAR1IDO1LIPGTDP1CYP1A2 | |
| SCHEMBL2177804 | 0.84 | LIPG (0.42) | TAAR1LIPGTDP1HTR2AMGLL | |
| SCHEMBL9860715 | 0.84 | LIPG (0.42) | TAAR1LIPGTDP1HTR2AMGLL | |
| SCHEMBL7373618 | 0.82 | TAAR1 (0.60) | TAAR1IDO1TDP1CYP1A2CYP2D6 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110563619-B | Aryl alkyl sulfone compound and reduction coupling method for constructing sulfone compound | 华东师范大学 | 2021-07-27 | — | — | CN | disclosed |
| CN-110563619-A | Aryl alkyl sulfone compound and reduction coupling method for constructing sulfone compound | 华东师范大学 | 2019-12-13 | — | — | CN | disclosed |
| US-6063940-A | Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-05-16 | — | — | US | disclosed |
| US-5637736-A | Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-06-10 | — | — | US | disclosed |
| EP-0637580-A1 | Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1995-02-08 | — | — | EP | disclosed |