Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 5/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PTPRG | P23470 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
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 SCHEMBL11632741 | 0.78 | IDO1 (0.58) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL8345822 | 0.78 | TDP1 (0.62) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| Hydrochloric Acid SCHEMBL11842725 | 0.76 | TDP1 (0.61) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL14611678 | 0.76 | IDO1 (0.57) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL6689595 | 0.76 | IDO1 (0.68) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL15424828 | 0.73 | TDP1 (0.62) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL11444333 | 0.72 | IDO1 (0.57) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL22767269 | 0.72 | TDP1 (0.65) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| SCHEMBL10409192 | 0.72 | IDO1 (0.52) | IDO1TDP1L3MBTL1ALDH1A1MEN1 | |
| Butane SCHEMBL7059838 | 0.70 | IDO1 (0.59) | IDO1TDP1L3MBTL1ALDH1A1MEN1 |
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 |