Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 SCHEMBL4348821 | 0.98 | SIGMAR1 (0.52) | SIGMAR1CYP1A2BCHEKDM1AMAOA | |
| SCHEMBL10037102 | 0.94 | SIGMAR1 (0.62) | SIGMAR1CYP1A2BCHEMEN1KMT2A | |
| SCHEMBL8394039 | 0.91 | SIGMAR1 (0.42) | SIGMAR1CYP1A2BCHEKDM1AMAOA | |
| SCHEMBL14176596 | 0.86 | MEN1 (0.47) | SIGMAR1CYP1A2BCHEKDM1AMAOA | |
| SCHEMBL20666382 | 0.84 | MEN1 (0.45) | SIGMAR1CYP1A2BCHEMEN1KMT2A | |
| SCHEMBL3037811 | 0.82 | SIGMAR1 (0.39) | SIGMAR1CYP1A2BCHEKDM1AMAOA | |
| SCHEMBL25492964 | 0.82 | ITGB3 (0.40) | SIGMAR1CYP1A2BCHEKDM1AMAOA | |
| SCHEMBL26349895 | 0.80 | SIGMAR1 (0.41) | SIGMAR1CYP1A2KDM1AMAOBMEN1 | |
| SCHEMBL12403210 | 0.79 | MEN1 (0.41) | SIGMAR1CYP1A2BCHEMEN1KMT2A | |
| SCHEMBL25122577 | 0.79 | HRH3 (0.40) | SIGMAR1CYP1A2BCHEKDM1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1496053-B1 | Kappa-opioid receptor agonist comprising a 2-phenylbenzothiazoline derivative | SANTEN PHARMACEUTICAL CO LTD (JP) | 2012-06-20 | — | — | EP | disclosed |
| EP-2042173-A2 | Kappa-opioid receptor agonist comprising 2-phenylbenzothiazoline derivative | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2009-04-01 | — | — | EP | disclosed |
| US-7410987-B2 | Method for treating pain or pruritis by administering κ-opioid receptor agonist comprising 2-phenylbenzothiazoline derivative | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2008-08-12 | — | — | US | disclosed |
| US-7410987-B2 | Method for treating pain or pruritis by administering κ-opioid receptor agonist comprising 2-phenylbenzothiazoline derivative | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2008-08-12 | — | — | US | disclosed |