Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 1/20 | 0.33 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL12601427 | 0.72 | GPR3 (0.34) | GPR3MEN1KMT2ANOX1CYP1A2 | |
| SCHEMBL30708217 | 0.68 | CXCR2 (0.35) | GPR3PLCG1MEN1KMT2ANOX1 | |
| SCHEMBL19194985 | 0.68 | CXCR2 (0.35) | GPR3PLCG1MEN1KMT2ANOX1 | |
| SCHEMBL29507678 | 0.68 | TSHR (0.44) | CYP1A2 | |
| SCHEMBL44447 | 0.68 | TSHR (0.44) | CYP1A2 | |
| SCHEMBL560870 | 0.67 | GPR3 (0.37) | GPR3PLCG1MEN1KMT2ANOX1 | |
| SCHEMBL61667 | 0.67 | CA1 (0.47) | GPR3PLCG1MEN1KMT2ANOX1 | |
| SCHEMBL30533792 | 0.67 | CA1 (0.47) | GPR3PLCG1MEN1KMT2ANOX1 | |
| SCHEMBL27595871 | 0.67 | PLCG1 (0.36) | GPR3PLCG1MEN1KMT2ANOX1 | |
| Methane SCHEMBL27705728 | 0.66 | TSHR (0.42) | CYP1A2 |
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-1091953-A1 | NOVEL BENZOTHIEPINES HAVING ACTIVITY AS INHIBITORS OF ILEAL BILE ACID TRANSPORT AND TAUROCHOLATE UPTAKE | G.D. Searle & Co. (US) | 2001-04-18 | — | — | EP | disclosed |
| WO-2000001687-A9 | BENZOTHIEPINES HAVING ACTIVITY AS INHIBITORS OF ILEAL BILE ACID TRANSPORT AND TAUROCHOLATE UPTAKE | SEARLE & CO (US) | 2000-07-20 | — | — | WO | disclosed |
| WO-2000001687-A1 | BENZOTHIEPINES HAVING ACTIVITY AS INHIBITORS OF ILEAL BILE ACID TRANSPORT AND TAUROCHOLATE UPTAKE | G.D. SEARLE & CO. (US) | 2000-01-13 | — | — | WO | disclosed |