Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | PPM1D | O15297 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15632355 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL27274652 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL31234239 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL144330 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL141264 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL573307 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL15632374 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL1882303 | 1.00 | NR1H2 (0.36) | NR1H2CHRM2CHRM1CHRM3ALDH1A1 | |
| SCHEMBL24540367 | 0.91 | ALDH1A1 (0.36) | CHRM2CHRM1CHRM3ALDH1A1TSHR | |
| SCHEMBL23555453 | 0.91 | ALDH1A1 (0.36) | CHRM2CHRM1CHRM3ALDH1A1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022187206-A1 | DUAL-TARGET MU OPIOID AND DOPAMINE D3 RECEPTORS LIGANDS; PREPARATION AND USE THEREOF | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2022-09-09 | — | — | WO | disclosed |
| WO-1993011128-A1 | AMINOALKYLPYRROLIDINYLTHIOCARBAPENEM DERIVATIVES | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-06-10 | — | — | WO | disclosed |
| WO-1993001174-A1 | THIAZOLIDINE DERIVATIVES AND THEIR USE AS ANTI-VIRAL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 1993-01-21 | — | — | WO | disclosed |