Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21913809 | 0.93 | NPSR1 (0.49) | NPSR1SIRT2SIRT1NPC1RAB9A | |
| SCHEMBL18767471 | 0.92 | SIRT2 (0.47) | NPSR1SIRT2SIRT1AKR1C3NPC1 | |
| SCHEMBL17454719 | 0.88 | PTGER4 (0.43) | NPSR1NPC1RAB9AHPGDCXCR2 | |
| SCHEMBL17547175 | 0.87 | SIRT2 (0.48) | NPSR1SIRT2SIRT1AKR1C3NPC1 | |
| SCHEMBL18731241 | 0.87 | SIRT2 (0.55) | SIRT2SIRT1AKR1C3HPGDSYK | |
| SCHEMBL17547221 | 0.86 | SIRT2 (0.47) | NPSR1SIRT2SIRT1AKR1C3NPC1 | |
| SCHEMBL18767302 | 0.86 | SIRT2 (0.47) | NPSR1SIRT2SIRT1AKR1C3NPC1 | |
| SCHEMBL17661463 | 0.85 | SIRT2 (0.49) | NPSR1SIRT2SIRT1AKR1C3NPC1 | |
| SCHEMBL17454796 | 0.85 | SIRT2 (0.54) | SIRT2SIRT1AKR1C3HPGDSYK | |
| SCHEMBL17661366 | 0.84 | NPSR1 (0.51) | NPSR1SIRT2SIRT1AKR1C3MAPT |
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-2017065419-A1 | ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) | 2017-04-20 | — | — | WO | disclosed |