Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2B6 | P20813 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 6/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.45 |
| ▸ | HTR1A | P08908 | 3/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD1 | P21728 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | SCN1A | P35498 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11201380 | 0.78 | CYP2B6 (0.52) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL11201375 | 0.78 | CYP2B6 (0.52) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL4296469 | 0.76 | CYP2B6 (0.59) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL12469656 | 0.76 | CYP2B6 (0.59) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL1337702 | 0.76 | CYP2B6 (0.59) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL2423921 | 0.74 | CYP2B6 (0.55) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL25772069 | 0.74 | CYP2B6 (0.55) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL1338545 | 0.74 | CYP2B6 (0.55) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL27323649 | 0.73 | CYP2B6 (0.55) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 | |
| SCHEMBL2491599 | 0.71 | CYP2B6 (0.63) | CYP2B6CHRM2CHRM1CYP2D6KCNH2 |
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-4404215-A | ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS | SCIENCE UNION ET CIE (FR) | 1983-09-13 | — | — | US | disclosed |