Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | CASR | P41180 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL10872292 | 0.84 | ALDH1A1 (0.43) | ALDH1A1CYP3A4CASRCHRM2HTR1A | |
| SCHEMBL6155787 | 0.81 | MTOR (0.46) | ALDH1A1CYP3A4LMNAMEN1KMT2A | |
| SCHEMBL10689037 | 0.80 | SIGMAR1 (0.50) | ALDH1A1CYP3A4CASRCHRM2HTR1A | |
| SCHEMBL27439569 | 0.79 | TSHR (0.41) | OPRM1LMNAMEN1KMT2ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL27732492 | 0.79 | SIGMAR1 (0.49) | ALDH1A1CYP3A4CASRCHRM2HTR1A | |
| SCHEMBL10035171 | 0.78 | TAAR1 (0.39) | LMNATAAR1POLBAOC3 | |
| SCHEMBL28122425 | 0.78 | ALDH1A1 (0.42) | ALDH1A1LMNAMEN1KMT2APOLB | |
| SCHEMBL8699238 | 0.76 | LMNA (0.47) | ALDH1A1CYP3A4CASRCHRM2HTR1A | |
| SCHEMBL9055270 | 0.76 | ALDH1A1 (0.55) | ALDH1A1CYP3A4CASRCHRM2HTR1A | |
| SCHEMBL9691871 | 0.73 | MMP8 (0.38) | ALDH1A1CYP3A4LMNAMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105873634-A | System for transdermal delivery of active substances | LTS勒曼治疗系统股份公司 | 2016-08-17 | — | — | CN | disclosed |
| CN-101454027-A | Curable hydrophilic compositions | 3M INNOVATIVE PROPERTIES CO (US) | 2009-06-10 | — | — | CN | disclosed |
| CN-1638720-A | Silicone elastomer emulsion cosmetic compositions comprising internal phase comprising colorant | PROCTER & GAMBLE (US) | 2005-07-13 | — | — | CN | disclosed |