Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SLC9A3 | P48764 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA3 | P07451 | 3/20 | 0.46 |
| ▸ | CA4 | P22748 | 3/20 | 0.46 |
| ▸ | CA6 | P23280 | 3/20 | 0.46 |
| ▸ | CA5A | P35218 | 3/20 | 0.46 |
| ▸ | CA7 | P43166 | 3/20 | 0.46 |
| ▸ | CA9 | Q16790 | 3/20 | 0.46 |
| ▸ | CA13 | Q8N1Q1 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9772385 | 1.00 | SIGMAR1 (0.47) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL9772450 | 0.87 | SIGMAR1 (0.61) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL7963090 | 0.87 | SIGMAR1 (0.61) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL9704626 | 0.78 | SIGMAR1 (0.71) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL9492502 | 0.78 | SIGMAR1 (0.66) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL9251914 | 0.76 | SLC9A3 (0.43) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| 1,2-Dichlorobenzene SCHEMBL9643933 | 0.76 | SIGMAR1 (0.54) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| 1,2-Dichlorobenzene SCHEMBL9643364 | 0.75 | SIGMAR1 (0.53) | SIGMAR1OPRM1OPRD1OPRK1CYP2D6 | |
| SCHEMBL9772383 | 0.74 | SIGMAR1 (0.48) | SIGMAR1OPRM1OPRD1OPRK1CYP1A2 | |
| SCHEMBL7964605 | 0.74 | SIGMAR1 (0.48) | SIGMAR1OPRM1OPRD1OPRK1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6271395-B1 | E.G.,(.+-.)-N-(2,3-DIHYDRO-2-(1-PYRROLIDINYL)-1H-INDEN-1-Y1) -2 ,4-DINITRO-N-METHYL-BENZENE-ACETAMIDE; STRONG AFFINITY FOR OPTICAL RECEPTORS, CENTRAL ANALGESIC, DIURETIC, ANTIARRYTHMIC, HYPOTENSIVE AND ANTIISCHEMIC ACTIVITY. | HOECHST MARION ROUSSOL (FR) | 2001-08-07 | — | — | US | disclosed |
| EP-0258096-B1 | INDANE DERIVATIVES, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THE INTERMEDIATES OBTAINED | ROUSSEL-UCLAF (FR) | 1992-09-09 | — | — | EP | disclosed |