Known targets — ChEMBL curated mechanism
CHRM1CHRM2CHRM3CHRM4CHRM5SLC6A2dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 known ✓ | P08173 | 1/20 | 0.35 |
| ▸ | CHRM5 known ✓ | P08912 | 1/20 | 0.35 |
| ▸ | CHRM1 known ✓ | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 2/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 2/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10341022 | 1.00 | APP (0.38) | APPCNR2NFE2L2MCHR1KDM4A | |
| SCHEMBL10340808 | 0.93 | KDM4A (0.38) | APPCNR2NFE2L2MCHR1KDM4A | |
| SCHEMBL10340924 | 0.93 | KDM4A (0.38) | APPCNR2NFE2L2MCHR1KDM4A | |
| SCHEMBL10340901 | 0.93 | KDM4A (0.38) | APPCNR2NFE2L2MCHR1KDM4A | |
| SCHEMBL10340936 | 0.89 | APP (0.38) | APPCNR2NFE2L2MCHR1KDM4A | |
| SCHEMBL10340838 | 0.87 | APP (0.46) | APPNFE2L2KDM4AKDM2ACHRM2 | |
| SCHEMBL10340863 | 0.87 | APP (0.46) | APPNFE2L2KDM4AKDM2ACHRM2 | |
| SCHEMBL10340839 | 0.87 | APP (0.46) | APPNFE2L2KDM4AKDM2ACHRM2 | |
| SCHEMBL10340864 | 0.87 | APP (0.46) | APPNFE2L2KDM4AKDM2ACHRM2 | |
| SCHEMBL10340816 | 0.82 | KDM4A (0.40) | APPCNR2NFE2L2MCHR1KDM4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0348497-A1 | NON-LINEAR OPTICAL MATERIAL CONTAINING A HEMICYANINE COMPOUND AND PROCESS FOR PRODUCING IT | MERCK PATENT GmbH (DE) | 1990-01-03 | — | — | EP | disclosed |
| WO-1989005843-A1 | NON-LINEAR OPTICAL MATERIAL CONTAINING A HEMICYANINE COMPOUND AND PROCESS FOR PRODUCING IT | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1989-06-29 | — | — | WO | disclosed |