Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 5/20 | 0.58 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.58 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.58 |
| ▸ | DRD1 | P21728 | 2/20 | 0.58 |
| ▸ | DRD3 | P35462 | 2/20 | 0.58 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.58 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.58 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.58 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.58 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.58 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | HTR2C | P28335 | 1/20 | 0.58 |
| ▸ | HRH1 | P35367 | 1/20 | 0.58 |
| ▸ | HTR2B | P41595 | 1/20 | 0.58 |
| ▸ | OPRD1 | P41143 | 4/20 | 0.54 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9899985 | 0.80 | OPRM1 (0.63) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL8186671 | 0.79 | OPRM1 (0.78) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL7977689 | 0.79 | OPRM1 (0.78) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL3919536 | 0.79 | OPRM1 (0.78) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL8175607 | 0.79 | OPRM1 (0.78) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL13784937 | 0.77 | OPRM1 (0.63) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL11435778 | 0.74 | KMT2A (0.52) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL4249531 | 0.74 | OPRM1 (0.59) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL8371748 | 0.74 | OPRD1 (0.67) | OPRM1CHRM2ADRA2ACHRM1DRD1 | |
| SCHEMBL9222698 | 0.74 | CHRM2 (0.59) | OPRM1CHRM2ADRA2ACHRM1DRD1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107337632-A | A kind of preparation method of CV-4093 | 江西永通科技股份有限公司 | 2017-11-10 | — | — | CN | claimed |
| CN-106518806-A | Preparation method for manidipine intermediate 2-(4-diphenylmethyl piperazine)ethyl acetoacetate | 张家港威胜生物医药有限公司 | 2017-03-22 | — | — | CN | claimed |
| CN-106380442-A | Preparation method of calcium ion channel antagonist manidipine | 张家港威胜生物医药有限公司 | 2017-02-08 | — | — | CN | claimed |
| CN-107337632-A | A kind of preparation method of CV-4093 | 江西永通科技股份有限公司 | 2017-11-10 | — | — | CN | disclosed |
| CN-106518806-A | Preparation method for manidipine intermediate 2-(4-diphenylmethyl piperazine)ethyl acetoacetate | 张家港威胜生物医药有限公司 | 2017-03-22 | — | — | CN | disclosed |
| CN-106380442-A | Preparation method of calcium ion channel antagonist manidipine | 张家港威胜生物医药有限公司 | 2017-02-08 | — | — | CN | disclosed |