Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 5/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.30 |
| ▸ | TACR2 | P21452 | 2/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SHBG | P04278 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.30 |
| ▸ | ADRB3 | P13945 | 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 | |
|---|---|---|---|---|
| SCHEMBL16683762 | 0.78 | PTGS2 (0.35) | PTGS2AKT1KDM4EHSD17B10CYP3A4 | |
| SCHEMBL19357024 | 0.78 | TLR8 (0.33) | — | |
| SCHEMBL18750447 | 0.77 | MAPK1 (0.36) | PTGS2AKT1KDM4EHSD17B10MAPK1 | |
| SCHEMBL196514 | 0.76 | PTGS2 (0.48) | PTGS2KDM4EHSD17B10CYP3A4ESR1 | |
| SCHEMBL3555634 | 0.76 | PTGS2 (0.48) | PTGS2KDM4EHSD17B10CYP3A4ESR1 | |
| SCHEMBL2012315 | 0.76 | PTGS2 (0.48) | PTGS2KDM4EHSD17B10CYP3A4ESR1 | |
| SCHEMBL1323842 | 0.76 | PTGS2 (0.48) | PTGS2KDM4EHSD17B10CYP3A4ESR1 | |
| SCHEMBL14985415 | 0.76 | PTGS2 (0.35) | PTGS2KDM4ECYP3A4ALDH1A1 | |
| SCHEMBL16683778 | 0.76 | KDM4E (0.38) | GPR35AKT1KDM4EHSD17B10MAPK1 | |
| SCHEMBL18267374 | 0.75 | PTGS2 (0.34) | PTGS2KDM4EHSD17B10CYP3A4ESR1 |
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-2015060183-A1 | ORGANIC SEMICONDUCTOR MATERIAL | 東洋紡株式会社 | 2015-04-30 | — | — | WO | disclosed |