Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.64 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.64 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.64 |
| ▸ | HTR1A | P08908 | 1/20 | 0.64 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.64 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.64 |
| ▸ | DRD2 | P14416 | 1/20 | 0.64 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.64 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.64 |
| ▸ | DRD1 | P21728 | 1/20 | 0.64 |
| ▸ | DRD4 | P21917 | 1/20 | 0.64 |
| ▸ | ACHE | P22303 | 1/20 | 0.64 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.64 |
| ▸ | HTR2A | P28223 | 1/20 | 0.64 |
| ▸ | HTR2C | P28335 | 1/20 | 0.64 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.64 |
| ▸ | CCKBR | P32239 | 1/20 | 0.64 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.64 |
| ▸ | HRH1 | P35367 | 1/20 | 0.64 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL929693 | 0.86 | CHRM2 (0.65) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| SCHEMBL930761 | 0.85 | HTR1A (0.62) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| SCHEMBL930760 | 0.84 | ABCB11 (0.63) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| Methyl Alcohol SCHEMBL929694 | 0.84 | ABCB11 (0.66) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| Alcohol SCHEMBL142048 | 0.84 | DRD2 (0.66) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| SCHEMBL21587534 | 0.83 | HTR1A (0.67) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| Methyl Alcohol SCHEMBL142049 | 0.82 | ABCB11 (0.66) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| Methane SCHEMBL7348385 | 0.82 | HTR1A (0.65) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| SCHEMBL9101152 | 0.81 | HTR1A (0.68) | KCNH2ABCB11CHRM2HTR1AADRA2A | |
| SCHEMBL9079655 | 0.81 | ABCB11 (0.70) | KCNH2ABCB11CHRM2HTR1AADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6207680-B1 | FOR THERAPY OF PSYCHOLOGICAL DISORDERS AND PAIN | AVENTIS PHARMACEUTICALS INC. | 2001-03-27 | — | — | US | disclosed |