Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM2 | O94759 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.35 |
| ▸ | TACR2 | P21452 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SHBG | P04278 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.35 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL2494293 | 0.87 | PTGS2 (0.44) | PTGS2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL2494295 | 0.87 | PTGS2 (0.44) | PTGS2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL10871414 | 0.83 | THRA (0.42) | — | |
| SCHEMBL10871110 | 0.83 | THRA (0.42) | — | |
| Iodide SCHEMBL8727898 | 0.82 | KDM4A (0.52) | KDM4ELMNATP53NPC1RAB9A | |
| SCHEMBL19513765 | 0.78 | PTGS2 (0.40) | PTGS2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL13410235 | 0.77 | ALDH1A1 (0.39) | PTGS2ESR1ADRA2AADORA3TACR2 | |
| SCHEMBL13322020 | 0.75 | TRPM2 (0.47) | TRPM2PTGS2ESR1ADRA2AADORA3 | |
| SCHEMBL14310761 | 0.75 | TRPM2 (0.40) | TRPM2PTGS2ESR1ADRA2AADORA3 | |
| SCHEMBL12744549 | 0.74 | MAPT (0.39) | TRPM2ALDH1A1TNNC1 |
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-8102113-B2 | Quinoxaline-containing compounds and polymers thereof | FUJI XEROX CO., LTD. (JP) | 2012-01-24 | — | — | US | disclosed |
| US-20090231240-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT AND DISPLAY DEVICE | FUJI XEROX CO., LTD. (JP) | 2009-09-17 | — | — | US | disclosed |