Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.60 |
| ▸ | MC4R | P32245 | 4/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 2/20 | 0.49 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.47 |
| ▸ | HTR3B | O95264 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | HTR1D | P28221 | 1/20 | 0.47 |
| ▸ | HTR1B | P28222 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HTR5A | P47898 | 1/20 | 0.47 |
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 SCHEMBL6330371 | 0.94 | MC4R (0.62) | SIGMAR1MC4RTAAR1 | |
| SCHEMBL2378007 | 0.91 | TDP1 (0.55) | SIGMAR1MC4RTAAR1SLC6A4TDP1 | |
| Hydrochloric Acid SCHEMBL17444674 | 0.89 | TDP1 (0.54) | SIGMAR1MC4RTAAR1SLC6A4TDP1 | |
| SCHEMBL4160738 | 0.82 | LMNA (0.53) | SIGMAR1MC4RTAAR1SLC6A4TDP1 | |
| SCHEMBL1020430 | 0.81 | ACHE (0.62) | SIGMAR1SLC6A4HTR1AHTR3EHTR3B | |
| SCHEMBL29567963 | 0.81 | ACHE (0.62) | SIGMAR1SLC6A4HTR1AHTR3EHTR3B | |
| SCHEMBL16689990 | 0.81 | ACHE (0.62) | SIGMAR1SLC6A4HTR1AHTR3EHTR3B | |
| Bromide SCHEMBL9067059 | 0.80 | ACHE (0.60) | SIGMAR1SLC6A4HTR1AHTR3EHTR3B | |
| SCHEMBL16830451 | 0.80 | ACHE (0.60) | SIGMAR1SLC6A4HTR1AHTR3EHTR3B | |
| SCHEMBL9378687 | 0.79 | DRD3 (0.64) | SIGMAR1MC4RSLC6A4HTR1ACYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0507863-A4 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | — | 1993-07-07 | — | — | EP | claimed |
| EP-0507863-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1992-10-14 | — | — | EP | claimed |
| WO-1991009594-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1991-07-11 | — | — | WO | claimed |