Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 8/20 | 0.97 |
| ▸ | PARP1 | P09874 | 1/20 | 0.54 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9309721 | 0.83 | SIGMAR1 (0.97) | SIGMAR1PARP1 | |
| SCHEMBL9309563 | 0.81 | SIGMAR1 (0.97) | SIGMAR1PARP1 | |
| Hydrochloric Acid SCHEMBL9308175 | 0.80 | SIGMAR1 (1.00) | SIGMAR1PARP1 | |
| SCHEMBL6512477 | 0.76 | HRH3 (0.68) | SIGMAR1DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL9306818 | 0.74 | SIGMAR1 (0.64) | SIGMAR1 | |
| SCHEMBL7378750 | 0.73 | SLC6A3 (0.58) | SIGMAR1DRD2 | |
| Hydrochloric Acid SCHEMBL9308470 | 0.73 | SIGMAR1 (0.67) | SIGMAR1 | |
| SCHEMBL7386396 | 0.73 | SIGMAR1 (1.00) | SIGMAR1PARP1 | |
| SCHEMBL10565610 | 0.72 | HTR1A (0.71) | SIGMAR1PARP1DRD2HTR2A | |
| SCHEMBL31629019 | 0.72 | SLC6A3 (0.56) | SIGMAR1DRD2HTR2AHTR2CHTR2B |
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-2002030422-A1 | USE OF DEFINED SUBSTANCES THAT BIND TO THE SIGMA RECEPTOR FOR COMBATING SARCOMA AND CARCINOMA | MERCK PATENT GMBH (DE) | 2002-04-18 | — | — | WO | claimed |
| WO-2002030422-A1 | USE OF DEFINED SUBSTANCES THAT BIND TO THE SIGMA RECEPTOR FOR COMBATING SARCOMA AND CARCINOMA | MERCK PATENT GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |
| WO-2002030422-A1 | USE OF DEFINED SUBSTANCES THAT BIND TO THE SIGMA RECEPTOR FOR COMBATING SARCOMA AND CARCINOMA | MERCK PATENT GMBH (DE) | 2002-04-18 | — | — | WO | disclosed |