Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 6/20 | 0.52 |
| ▸ | DRD2 | P14416 | 6/20 | 0.52 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.51 |
| ▸ | BLM | P54132 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 8/20 | 0.50 |
| ▸ | HRH1 | P35367 | 4/20 | 0.50 |
| ▸ | DRD3 | P35462 | 3/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.50 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.50 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.50 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.50 |
| ▸ | DRD1 | P21728 | 3/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.50 |
| ▸ | HTR2A | P28223 | 3/20 | 0.50 |
| ▸ | HTR2C | P28335 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11666986 | 0.91 | CHRM1 (0.57) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11531362 | 0.87 | CHRM1 (0.62) | DRD4DRD2HRH4CHRM1HRH1 | |
| SCHEMBL11633189 | 0.87 | DRD2 (0.61) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11631048 | 0.87 | CHRM1 (0.61) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11631603 | 0.85 | DRD2 (0.49) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11634162 | 0.85 | CHRM1 (0.63) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11531378 | 0.84 | DRD2 (0.74) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11534075 | 0.82 | CHRM1 (0.52) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11529616 | 0.82 | CHRM1 (0.55) | DRD4DRD2HRH4NFKB1BLM | |
| SCHEMBL11632479 | 0.81 | CHRM1 (0.71) | DRD4DRD2HRH4NFKB1BLM |
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-4115574-A | CNS ACTIVITY | LILLY INDUSTRIES LIMITED (GB) | 1978-09-19 | — | — | US | disclosed |
| US-4115568-A | CNS ACTIVITY | LILLY INDUSTRIES LIMITED (GB) | 1978-09-19 | — | — | US | disclosed |