Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.71 |
| ▸ | ESR2 | Q92731 | 10/20 | 0.71 |
| ▸ | PGR | P06401 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | DRD1 | P21728 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL1838502 | 0.84 | ESR1 (0.86) | ESR1ESR2PGRLMNACYP1A2 | |
| Isobutesrol SCHEMBL5694505 | 0.83 | ESR1 (1.00) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL28855812 | 0.83 | ESR1 (0.44) | ESR1ESR2PGRLMNAMAPT | |
| SCHEMBL22500212 | 0.79 | ESR1 (0.70) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL1833902 | 0.79 | ESR1 (0.89) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL1836841 | 0.79 | ESR1 (0.82) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL17047779 | 0.79 | ESR1 (0.89) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL984070 | 0.77 | ESR1 (0.72) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL1838575 | 0.76 | ESR1 (0.83) | ESR1ESR2PGRLMNACYP1A2 | |
| SCHEMBL28059678 | 0.76 | ESR1 (0.83) | ESR1ESR2PGRLMNACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102105439-B | Method for producing N-substituted carbamate and method for producing isocyanate using the N-substituted carbamate | ASAHI KASEI CHEMICALS CORP. (JP) | 2016-04-20 | — | — | CN | disclosed |