Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 20/20 | 0.55 |
| ▸ | HTR2C | P28335 | 4/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | DRD1 | P21728 | 1/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | GPR183 | P32249 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | APLNR | P35414 | 1/20 | 0.47 |
| ▸ | DRD3 | P35462 | 1/20 | 0.47 |
| ▸ | CX3CR1 | P49238 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL25466903 | 0.78 | HTR2A (0.79) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20767191 | 0.76 | HTR2A (0.57) | HTR2ACHRM1OPRM1HRH3 | |
| SCHEMBL20766900 | 0.76 | HTR2A (0.68) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20766920 | 0.75 | HTR2A (0.56) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20781016 | 0.74 | HTR2A (0.65) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20781090 | 0.73 | HTR2A (0.56) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL30504379 | 0.73 | HTR2A (0.54) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20766953 | 0.72 | HTR2A (0.68) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20767249 | 0.72 | HTR2A (0.52) | HTR2AHTR2CABCB11CYP1A2ADRB2 | |
| SCHEMBL20766869 | 0.72 | HTR2A (0.50) | HTR2AHTR2CABCB11CYP1A2ADRB2 |
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-113549006-A | Amide derivative and application thereof | 江苏恩华药业股份有限公司 | 2021-10-26 | — | — | CN | claimed |
| CN-113549006-B | Amide derivative and application thereof | 江苏恩华药业股份有限公司 | 2023-07-21 | — | — | CN | disclosed |
| CN-113549006-A | Amide derivative and application thereof | 江苏恩华药业股份有限公司 | 2021-10-26 | — | — | CN | disclosed |