Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 2/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.36 |
| ▸ | DRD1 | P21728 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | HRH1 | P35367 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | HTR3A | P46098 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24675065 | 1.00 | HTR2A (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675072 | 0.83 | CYP1A2 (0.32) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675021 | 0.77 | ALDH1A1 (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675023 | 0.75 | CCKBR (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675025 | 0.75 | CCKBR (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675037 | 0.75 | CCKBR (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675048 | 0.74 | PIK3CA (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675046 | 0.74 | PIK3CA (0.36) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675036 | 0.73 | ALDH1A1 (0.34) | HTR2ACYP1A2CHRM2HTR1AADRA2A | |
| SCHEMBL24675047 | 0.73 | VRK1 (0.37) | HTR2ACYP1A2CHRM2HTR1AADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022223022-A1 | FUSED-RING HETEROCYCLE DERIVATIVE AND MEDICAL APPLICATION THEREOF | 四川海思科制药有限公司 | 2022-10-27 | — | — | WO | disclosed |