Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | CPB1 | P15086 | 1/20 | 0.42 |
| ▸ | FABP7 | O15540 | 1/20 | 0.42 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7996223 | 1.00 | TSHR (0.57) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL7994521 | 1.00 | TSHR (0.57) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL29565334 | 0.88 | TSHR (0.47) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL15251729 | 0.87 | TSHR (0.59) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL20418703 | 0.87 | TSHR (0.59) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL629930 | 0.87 | TSHR (0.59) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL11607523 | 0.87 | CA1 (0.47) | TSHRBACE1FKBP1A | |
| SCHEMBL13967418 | 0.86 | TSHR (0.56) | TSHRBACE1HTR2CALDH1A1GLA | |
| Hydrochloric Acid SCHEMBL7406170 | 0.86 | TSHR (0.62) | TSHRBACE1HTR2CALDH1A1GLA | |
| SCHEMBL5268005 | 0.83 | TSHR (0.50) | TSHRBACE1HTR2CALDH1A1GLA |
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-2011039290-A1 | A PROCESS FOR THE PREPARATION OF TRANS-(2R)-4-SUBSTITUTED-PIPECOLIC ACIDS AND ESTERS THEREOF, AND INTERMEDIATE COMPOUNDS USED THEREIN | ENANTIA, S.L. (ES) | 2011-04-07 | — | — | WO | disclosed |
| WO-2001058872-A1 | METHOD FOR DIASTEREOSELECTIVE PREPARATION OF PIPERIDINES FUNCTIONALISED IN POSITIONS 2 AND 4 FOR USE AS SYNTHESIS INTERMEDIATES | RHODIA CHIMIE (FR) | 2001-08-16 | — | — | WO | disclosed |