Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 1/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.61 |
| ▸ | QDPR | P09417 | 2/20 | 0.53 |
| ▸ | HTR2A | P28223 | 5/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR2B | P41595 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC6A1 | P30531 | 1/20 | 0.38 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29140051 | 0.80 | ADRA2A (0.61) | ADRA2AADRA2BHTR2AHTR2CHTR2B | |
| SCHEMBL8960144 | 0.80 | ADRA2A (0.61) | ADRA2AADRA2BHTR2AHTR2CHTR2B | |
| SCHEMBL8960083 | 0.80 | ADRA2A (0.61) | ADRA2AADRA2BHTR2AHTR2CHTR2B | |
| SCHEMBL10354311 | 0.79 | QDPR (0.68) | ADRA2AADRA2BQDPRHTR2CESR1 | |
| SCHEMBL4789087 | 0.79 | ADRA2A (0.59) | ADRA2AADRA2BHTR2AHTR2CHTR2B | |
| SCHEMBL13490583 | 0.79 | CHRM2 (0.43) | ADRA2AADRA2BQDPRHTR2AHTR2C | |
| Bromide SCHEMBL11196323 | 0.78 | ADRA2A (0.58) | ADRA2AADRA2BQDPRHTR2AHTR2C | |
| Hydrochloric Acid SCHEMBL10354312 | 0.78 | QDPR (0.66) | ADRA2AADRA2BQDPRHTR2CESR1 | |
| Hydrochloric Acid SCHEMBL9252509 | 0.78 | ADRA2A (0.58) | ADRA2AADRA2BHTR2AHTR2CHTR2B | |
| SCHEMBL29140044 | 0.77 | ADRA2A (0.57) | ADRA2AADRA2BHTR2AHTR2CHTR2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109810047-A | (R) synthetic method of the chiral intermediate of -3- Phenylpiperidine or/and (S) -3- Phenylpiperidine and Ni Lapani | 上海博邦医药科技有限公司 | 2019-05-28 | — | — | CN | disclosed |
| EP-0691956-A1 | 3-PHENYL-1,2,5,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEDATIVES | LABORATOIRE L. LAFON (FR) | 1996-01-17 | — | — | EP | disclosed |
| WO-1994022827-A1 | 3-PHENYL-1,2,5,6-TETRAHYDROPYRIDINE DERIVATIVES AS SEDATIVES | LABORATOIRE L. LAFON (FR) | 1994-10-13 | — | — | WO | disclosed |