Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | CASP6 | P55212 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20006496 | 0.77 | MAOA (0.38) | MAOACASP6MIFMAOBALDH1A1 | |
| SCHEMBL24223383 | 0.77 | MAOA (0.38) | MAOACASP6MIFMAOBALDH1A1 | |
| SCHEMBL27837652 | 0.73 | MTNR1A (0.41) | PTGS2MAOAKDRADORA2AADORA1 | |
| SCHEMBL19089891 | 0.72 | MAOA (0.34) | MAOACASP6MIFMAOBALDH1A1 | |
| SCHEMBL19178623 | 0.72 | MAOA (0.34) | MAOACASP6MIFMAOBALDH1A1 | |
| SCHEMBL11546612 | 0.72 | MAOA (0.40) | PTGS2MAOAKDRADORA2AADORA1 | |
| SCHEMBL16139564 | 0.70 | CES1 (0.44) | MAOAMTNR1AMTNR1BMIFMAOB | |
| SCHEMBL27837653 | 0.70 | MTNR1A (0.39) | PTGS2MAOAMTNR1AMTNR1BALDH1A1 | |
| SCHEMBL9764142 | 0.70 | PTGS2 (0.51) | PTGS2MAOACASP6ESR1ESR2 | |
| SCHEMBL132494 | 0.70 | ESR2 (0.59) | PTGS2MAOAKDRADORA2AADORA1 |
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-2020032574-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2020-02-13 | — | — | WO | disclosed |