Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.35 |
| ▸ | ESR1 | P03372 | 4/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | DHFR | P00374 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 2/20 | 0.30 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.30 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14516042 | 0.97 | SIGMAR1 (0.37) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL15762753 | 0.97 | SIGMAR1 (0.37) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL9963825 | 0.97 | SIGMAR1 (0.37) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL2613891 | 0.96 | SIGMAR1 (0.36) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL2613781 | 0.96 | SIGMAR1 (0.36) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL14489459 | 0.96 | ESR1 (0.36) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL13333604 | 0.96 | ESR1 (0.36) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 | |
| SCHEMBL12014668 | 0.95 | SIGMAR1 (0.38) | SIGMAR1ESR1ESR2CYP1A2DHFR | |
| SCHEMBL12928338 | 0.95 | SIGMAR1 (0.38) | SIGMAR1ESR1ESR2CYP1A2DHFR | |
| SCHEMBL24638518 | 0.93 | SIGMAR1 (0.36) | SIGMAR1ESR1ESR2HSD17B1HSD17B2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007021117-A1 | GREEN ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | GRACEL DISPLAY INC. (KR) | 2007-02-22 | — | — | WO | disclosed |