Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.46 |
| ▸ | HTR2B | P41595 | 2/20 | 0.46 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 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 | |
|---|---|---|---|---|
| SCHEMBL13078126 | 0.84 | ADRA2A (0.40) | HTR2AHTR2CHTR2BMTNR1AADRA2A | |
| SCHEMBL8279306 | 0.76 | MTNR1A (0.47) | HTR2AHTR2CHTR2BMTNR1AKMT2A | |
| SCHEMBL15222073 | 0.72 | DRD2 (0.36) | DRD3RIPK1 | |
| SCHEMBL20904046 | 0.72 | HTR2A (0.43) | HTR2AHTR2CHTR2BMTNR1AADRA2A | |
| SCHEMBL29659945 | 0.71 | POLB (0.51) | MTNR1AKMT2ACHRM2CHRM1TSHR | |
| SCHEMBL811848 | 0.71 | POLB (0.51) | MTNR1AKMT2ACHRM2CHRM1TSHR | |
| SCHEMBL256377 | 0.71 | MTNR1A (0.50) | HTR2AHTR2CHTR2BMTNR1AADRA2A | |
| SCHEMBL15222054 | 0.71 | POLB (0.51) | MTNR1AKMT2ACHRM2CHRM1TSHR | |
| SCHEMBL9230128 | 0.71 | POLB (0.51) | MTNR1AKMT2ACHRM2CHRM1TSHR | |
| SCHEMBL23153720 | 0.70 | ADRA2A (0.41) | HTR2AHTR2CHTR2BMTNR1AADRA2A |
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-102725291-B | Bicyclic pyridine and relevant analog as Sirtuin regulator | 西特里斯药业公司 | 2016-12-21 | — | — | CN | disclosed |