Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.38 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.35 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11503302 | 0.80 | MPO (0.57) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| SCHEMBL6825529 | 0.80 | SIGMAR1 (0.46) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| SCHEMBL29446311 | 0.80 | SIGMAR1 (0.46) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| SCHEMBL9379776 | 0.80 | SIGMAR1 (0.46) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| SCHEMBL5489164 | 0.80 | SIGMAR1 (0.46) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| SCHEMBL28424372 | 0.80 | SIGMAR1 (0.46) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| Hydrochloric Acid SCHEMBL10649574 | 0.78 | SIGMAR1 (0.44) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| Hydrochloric Acid SCHEMBL15053825 | 0.78 | SIGMAR1 (0.44) | SIGMAR1CES1MPOG6PC1CYP2A6 | |
| SCHEMBL14290594 | 0.78 | SIGMAR1 (0.55) | SIGMAR1 | |
| SCHEMBL10395522 | 0.77 | SIGMAR1 (0.47) | SIGMAR1CES1MPOG6PC1CYP2A6 |
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-1465880-B1 | 5-SULPHANYL-4H-1,2,4-TRIAZOLE DERIVATIVES AND THEIR USE TO TREAT DISORDERS ASSOCIATED WITH SOMATOSTATINE | IPSEN PHARMA (FR) | 2009-08-05 | — | — | EP | disclosed |
| EP-1123285-A1 | SUBSTITUTED BENZOPYRAN ANALOGS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 2001-08-16 | — | — | EP | disclosed |
| WO-2000023433-A1 | SUBSTITUTED BENZOPYRAN ANALOGS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 2000-04-27 | — | — | WO | disclosed |