Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 3/20 | 0.57 |
| ▸ | HRH1 | P35367 | 2/20 | 0.57 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.57 |
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.52 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.52 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.52 |
| ▸ | DRD1 | P21728 | 2/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.45 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL11530673 | 0.87 | CHRM1 (0.76) | CHRM1HRH1PAK1 | |
| SCHEMBL11528346 | 0.86 | DRD2 (0.71) | CHRM1HRH1DRD2CHRM2CHRM4 | |
| SCHEMBL3414200 | 0.83 | CHRM1 (0.74) | CHRM1HRH1PAK1DRD2CHRM2 | |
| SCHEMBL11535575 | 0.83 | DRD2 (0.60) | CHRM1HRH1DRD2CHRM2CHRM4 | |
| SCHEMBL11536340 | 0.82 | CHRM1 (0.56) | CHRM1HRH1PAK1 | |
| SCHEMBL11530516 | 0.81 | DRD2 (0.51) | CHRM1HRH1PAK1DRD2CHRM2 | |
| SCHEMBL3429232 | 0.79 | CHRM1 (0.68) | CHRM1HRH1PAK1DRD2CHRM2 | |
| SCHEMBL3410996 | 0.79 | DRD2 (0.74) | CHRM1HRH1PAK1DRD2CHRM2 | |
| SCHEMBL11531624 | 0.79 | CHRM1 (0.54) | CHRM1HRH1PAK1DRD2CHRM2 | |
| SCHEMBL11531571 | 0.78 | CHRM1 (0.52) | CHRM1HRH1PAK1 |
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 |