Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 10/20 | 0.54 |
| ▸ | CHRM1 | P11229 | 10/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.54 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.54 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.54 |
| ▸ | DRD1 | P21728 | 5/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.54 |
| ▸ | ADRA1D | P25100 | 4/20 | 0.54 |
| ▸ | HTR2A | P28223 | 4/20 | 0.54 |
| ▸ | HTR2C | P28335 | 4/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.54 |
| ▸ | HRH1 | P35367 | 4/20 | 0.54 |
| ▸ | HTR2B | P41595 | 4/20 | 0.54 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.54 |
| ▸ | DRD4 | P21917 | 4/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11535917 | 0.87 | DRD2 (0.67) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL11531624 | 0.83 | CHRM1 (0.54) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL11529194 | 0.81 | MEN1 (0.49) | DRD2CHRM1DRD1HTR2CHRH1 | |
| SCHEMBL3410493 | 0.79 | CHRM1 (0.74) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL11532513 | 0.79 | HRH4 (0.49) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL11533130 | 0.77 | MEN1 (0.52) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL11535575 | 0.76 | DRD2 (0.60) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL11877889 | 0.76 | HRH4 (0.49) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL3429019 | 0.75 | CHRM1 (0.67) | DRD2CHRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL4431756 | 0.74 | CHRM1 (0.57) | DRD2CHRM1CHRM2CHRM4CHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| US-4172831-A | CENTRAL NERVOUS SYSTEM | LILLY INDUSTRIES LIMITED (GB) | 1979-10-30 | — | — | US | disclosed |
| US-4115568-A | CNS ACTIVITY | LILLY INDUSTRIES LIMITED (GB) | 1978-09-19 | — | — | US | disclosed |
| US-4115574-A | CNS ACTIVITY | LILLY INDUSTRIES LIMITED (GB) | 1978-09-19 | — | — | US | disclosed |