Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 3/20 | 0.53 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.53 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.53 |
| ▸ | DRD3 | P35462 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.53 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27980912 | 0.95 | IDO1 (0.53) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL1415333 | 0.90 | SLC6A2 (0.62) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL27936084 | 0.84 | IDO1 (0.50) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL27980718 | 0.83 | IDO1 (0.49) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL28000293 | 0.82 | NR5A1 (0.51) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL27936085 | 0.82 | NR5A1 (0.51) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL27981227 | 0.82 | NR5A1 (0.51) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL1953251 | 0.81 | CYP2D6 (0.48) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| SCHEMBL6751152 | 0.80 | SLC6A2 (0.51) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 | |
| Diphenhydramine SCHEMBL6904503 | 0.80 | LMNA (0.84) | SCN1ASCN2ASCN3ASLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103553972-B | Method for the preparation of n-substituted carbamic acid ester and method for the preparation of isocyanate using the n-substituted carbamic acid ester | 旭化成株式会社 | 2017-04-12 | — | — | CN | disclosed |
| CN-103588680-B | N-substituted carbamate conveying with and storage compositions and manufacture isocyanates method | 旭化成株式会社 | 2016-08-10 | — | — | CN | disclosed |