Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LSS | P48449 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2363531 | 0.88 | SIGMAR1 (0.35) | LSSSIGMAR1OPRM1OPRD1OPRK1 | |
| SCHEMBL12473169 | 0.88 | SHBG (0.32) | OPRM1OPRD1OPRK1 | |
| SCHEMBL14984946 | 0.78 | OPRM1 (0.34) | SIGMAR1OPRM1OPRD1OPRK1 | |
| SCHEMBL2163192 | 0.78 | ALDH1A1 (0.38) | SIGMAR1 | |
| SCHEMBL30750 | 0.76 | ALDH1A1 (0.41) | SIGMAR1 | |
| Fluoride SCHEMBL9620616 | 0.74 | ALDH1A1 (0.40) | SIGMAR1 | |
| Hydrochloric Acid SCHEMBL2957420 | 0.74 | ALDH1A1 (0.40) | SIGMAR1 | |
| Ammonia Solution, Strong SCHEMBL17439397 | 0.74 | ALDH1A1 (0.40) | SIGMAR1 | |
| SCHEMBL12403631 | 0.74 | — | — | |
| SCHEMBL7269723 | 0.73 | SIGMAR1 (0.31) | SIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4886812-A | REGULATING DOPAMINE CONCENTRATION; PARKINSON DISEASE, HYPOTENSIVE AGENT, SCHIZOPHRENIA | DR. KARL THOMAE GMBH (DE) | 1989-12-12 | — | — | US | disclosed |
| US-4843086-A | HYPOTENSIVE AGENTS, SCHIZOPHRENIA, PARKINSON'S DISEASE | BOEHRINGER INGELHEIM KG (DE) | 1989-06-27 | — | — | US | disclosed |
| US-4731374-A | PARKINSON*S DISEASE | DR. KARL THOMAE GMBH (DE) | 1988-03-15 | — | — | US | disclosed |
| EP-0186087-A1 | Tetrahydro-benzothiazoles, their production and their use as intermediates or drugs | Dr. Karl Thomae GmbH (DE) | 1986-07-02 | — | — | EP | disclosed |