Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.42 |
| ▸ | SCN1A | P35498 | 3/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.42 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | KCNE1 | P15382 | 2/20 | 0.40 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.38 |
| ▸ | HRH1 | P35367 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11807865 | 0.82 | KCNA5 (0.57) | TSHRSMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL1998300 | 0.81 | TSHR (0.49) | TSHRSMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL11877693 | 0.76 | KCNMA1 (0.35) | KCNMA1 | |
| SCHEMBL702161 | 0.75 | SMN1; SMN2 (0.49) | TSHRSMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL22275828 | 0.75 | SMN1; SMN2 (0.49) | TSHRSMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL29700907 | 0.75 | SMN1; SMN2 (0.49) | TSHRSMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL18988389 | 0.74 | TSHR (0.57) | TSHRSLC6A2SLC6A4CHRM2SCN1A | |
| SCHEMBL5429300 | 0.74 | SLC6A2 (0.48) | TSHRSMN1; SMN2MEN1GAAKMT2A | |
| SCHEMBL30679621 | 0.74 | TSHR (0.57) | TSHRSLC6A2SLC6A4CHRM2SCN1A | |
| SCHEMBL2937192 | 0.74 | SLC6A2 (0.48) | TSHRSMN1; SMN2MEN1GAAKMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0446097-A1 | Substituted etylamines, process for their preparation, their use as therapeutic agents and intermediates for their synthesis | JOUVEINAL S.A. (FR) | 1991-09-11 | — | — | EP | disclosed |
| US-3956494-A | ANTISECRETORY AGENTS, HETEROCYCLIC THIOPROPIONAMIDES | SMITHKLINE CORPORATION (US) | 1976-05-11 | — | — | US | disclosed |
| US-3950522-A | N-ALKENYL OR N-ALKYNYL THIOAMIDES | SMITHKLINE CORPORATION (US) | 1976-04-13 | — | — | US | disclosed |
| US-3948892-A | 2-Alkoxy(and 2-amino)-3-amino-2-heterocyclic-thiopropanamides | SMITHKLINE CORPORATION (US) | 1976-04-06 | — | — | US | disclosed |
| US-3933811-A | N-aminomethyl-2-amino(and 2-amino-methyl)-2-(2-quinolyl)-thioacetamides | SMITHKLINE CORPORATION (US) | 1976-01-20 | — | — | US | disclosed |