Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.45 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28325666 | 0.74 | HTR3E (0.59) | USP2ALDH1A1SMN1; SMN2CYP3A4TSHR | |
| SCHEMBL6153220 | 0.73 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2TSHRMAPTMAPK1 | |
| Ammonia Solution, Strong SCHEMBL18011917 | 0.73 | HTR3E (0.58) | USP2ALDH1A1SMN1; SMN2CYP3A4TSHR | |
| SCHEMBL4347686 | 0.72 | ALDH1A1 (0.51) | USP2ALDH1A1SMN1; SMN2CYP3A4HIF1A | |
| SCHEMBL30277734 | 0.71 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2MAPTMAPK1KMT2A | |
| SCHEMBL5531 | 0.70 | CYP3A4 (0.50) | USP2ALDH1A1SMN1; SMN2CYP3A4HIF1A | |
| SCHEMBL30976376 | 0.70 | SIGMAR1 (0.68) | TSHRKMT2AMEN1CYP2D6SIGMAR1 | |
| SCHEMBL28599511 | 0.69 | HTR3E (0.73) | ALDH1A1SMN1; SMN2TSHRMAPTKMT2A | |
| SCHEMBL29656856 | 0.69 | HTR3E (0.73) | ALDH1A1SMN1; SMN2TSHRMAPTKMT2A | |
| SCHEMBL30881157 | 0.69 | OPRL1 (0.51) | OPRM1OPRL1OPRD1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3699173-A1 | GEM-DISUBSTITUTED PYRROLIDINES, PIPERAZINES, AND DIAZEPANES, AND COMPOSITIONS AND METHODS OF MAKING THE SAME | California Institute of Technology (US) | 2020-08-26 | — | — | EP | disclosed |
| US-9453224-B2 | MiRNA modulators of thermogenesis | APTAMIR THERAPEUTICS, INC. (US) | 2016-09-27 | — | — | US | disclosed |