Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.53 |
| ▸ | CA1 | P00915 | 5/20 | 0.53 |
| ▸ | CA2 | P00918 | 5/20 | 0.53 |
| ▸ | CA9 | Q16790 | 5/20 | 0.53 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | NAAA | Q02083 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | LPAR2 | Q9HBW0 | 3/20 | 0.41 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9523836 | 0.89 | CA12 (0.46) | CA12CA1CA2CA9MGLL | |
| SCHEMBL15173121 | 0.83 | CA12 (0.52) | CA12CA1CA2CA9MGLL | |
| SCHEMBL10825706 | 0.82 | CA12 (0.43) | CA12CA1CA2CA9MGLL | |
| SCHEMBL8772708 | 0.80 | CA12 (0.47) | CA12CA1CA2CA9MGLL | |
| SCHEMBL9209555 | 0.80 | CA12 (0.46) | CA12CA1CA2CA9MGLL | |
| SCHEMBL11350975 | 0.79 | CA12 (0.34) | CA12CA1CA2CA9MGLL | |
| SCHEMBL7540022 | 0.78 | CA12 (0.56) | CA12CA1CA2CA9NAAA | |
| SCHEMBL1702174 | 0.78 | CA12 (0.52) | CA12CA1CA2CA9MGLL | |
| Methyl Alcohol SCHEMBL28317660 | 0.77 | CA12 (0.54) | CA12CA1CA2CA9NAAA | |
| SCHEMBL9873801 | 0.77 | ALDH1A1 (0.48) | CA12CA1CA2CA9MGLL |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004080938-A1 | SYNTHESIS OF S-ALKYL AND S-ARYL THIOCARBAMATES, ONE-POT TWO-STEP GENERAL SYNTHESIS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) | 2004-09-23 | — | — | WO | disclosed |
| US-6686494-B1 | PRECURSOR THIOL REAGENT IS FIRST REACTED WITH TRICHLOROACETYL CHLORIDE TO PRODUCE S-ALKYL OR S-ARYL TRICHLOROACETYL THIOESTER INTERMEDIATE, WHICH IS REACTED WITH AN AMINE TO YIELD THIOCARBAMATE PRODUCT | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY | 2004-02-03 | — | — | US | disclosed |