Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MECP2 | P51608 | 1/20 | 0.35 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.35 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19007621 | 0.86 | P2RX7 (0.43) | P2RX7NOS2ALDH1A1HPGDMEN1 | |
| SCHEMBL18885397 | 0.85 | P2RX7 (0.50) | P2RX7NOS2ALDH1A1HPGDMEN1 | |
| SCHEMBL15690774 | 0.83 | MEN1 (0.41) | P2RX7ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL18732426 | 0.83 | GAA (0.42) | P2RX7MAOAALDH1A1HPGDMEN1 | |
| SCHEMBL18852242 | 0.81 | P2RX7 (0.39) | P2RX7ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL18852008 | 0.81 | P2RX7 (0.39) | P2RX7ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL19007184 | 0.81 | P2RX7 (0.46) | P2RX7NOS2ALDH1A1HPGDMEN1 | |
| SCHEMBL19055067 | 0.81 | P2RX7 (0.41) | P2RX7NOS2ALDH1A1HPGDMEN1 | |
| SCHEMBL18253718 | 0.80 | P2RX7 (0.38) | P2RX7ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL15481518 | 0.80 | P2RX7 (0.41) | P2RX7ALDH1A1HPGDMEN1KMT2A |
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-2017099516-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2017-06-15 | — | — | WO | disclosed |