Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 6/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 6/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12498688 | 0.87 | KMT2A (0.52) | KMT2AADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL12499163 | 0.84 | POLB (0.48) | KMT2AADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL12498361 | 0.82 | KMT2A (0.47) | KMT2AADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL12498812 | 0.81 | ADRA1D (0.47) | KMT2AADRA1DADRA1AADRA1BPOLB | |
| SCHEMBL14368066 | 0.75 | ADRA1D (0.56) | ADRA1DADRA1AADRA1BADRB2ADRB1 | |
| SCHEMBL1412238 | 0.74 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BADRB2ADRB1 | |
| SCHEMBL1412240 | 0.74 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BADRB2ADRB1 | |
| SCHEMBL13880696 | 0.74 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BADRB2ADRB1 | |
| SCHEMBL29519545 | 0.74 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BADRB2ADRB1 | |
| SCHEMBL3948856 | 0.74 | ADRA1D (0.55) | ADRA1DADRA1AADRA1BADRB2ADRB1 |
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-2012101648-A1 | NOVEL PROCESS FOR THE SYNTHESIS OF ENANTIOMERICALLY PURE 2-METHOXY-5-[(2R)-2-(4-ALKYLPIPERAZIN-L-YL)PROPYL]-BENZENESULFONAMIDE | HAVALDAR FREDDY H | 2012-08-02 | — | — | WO | disclosed |