Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.50 |
| ▸ | HTR1A | P08908 | 3/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11487383 | 0.99 | CYP2D6 (0.52) | CYP2D6CHRM2CHRM1KCNH2HTR1A | |
| SCHEMBL11492974 | 0.91 | KDM4E (0.55) | CYP2D6CHRM2CHRM1KCNH2HTR1A | |
| SCHEMBL11487644 | 0.90 | LMNA (0.49) | CYP2D6CHRM2CHRM1KCNH2HTR1A | |
| SCHEMBL11494400 | 0.90 | CHRM4 (0.48) | CHRM2CHRM1LMNAMEN1KMT2A | |
| SCHEMBL11495151 | 0.89 | KMT2A (0.49) | LMNAMAPK1MEN1KMT2ACHRM3 | |
| SCHEMBL11492203 | 0.89 | CHRM2 (0.47) | CYP2D6CHRM2CHRM1KCNH2HTR1A | |
| SCHEMBL11486718 | 0.88 | KDM4E (0.48) | OPRM1LMNAMEN1KMT2AKDM4E | |
| SCHEMBL11489633 | 0.87 | ALDH1A1 (0.52) | LMNAMAPK1MEN1KMT2AKDM4E | |
| SCHEMBL11488616 | 0.87 | SLC6A4 (0.40) | CYP2D6CHRM2CHRM1KCNH2HTR1A | |
| SCHEMBL11487668 | 0.85 | KDM4E (0.55) | LMNAMEN1KMT2AKDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4239759-A | Morpholino containing compounds, compositions and use thereof | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1980-12-16 | — | — | US | disclosed |
| US-4110447-A | Anti-inflammatory (halo-4-biphenylyl)-alkanolamines | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1978-08-29 | — | — | US | disclosed |