Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.39 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.39 |
| ▸ | CSNK2A3 | Q8NEV1 | 2/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.38 |
| ▸ | GABRP | O00591 | 2/20 | 0.37 |
| ▸ | GABRD | O14764 | 2/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.37 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.37 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.37 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.37 |
| ▸ | GABRE | P78334 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23882004 | 1.00 | NPC1 (0.59) | NPC1RAB9ATNKSCSNK2A2CSNK2B | |
| SCHEMBL23903160 | 0.90 | NPC1 (0.59) | NPC1RAB9ATNKSCSNK2A2CSNK2B | |
| SCHEMBL26227945 | 0.84 | RAB9A (0.59) | NPC1RAB9ACSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL26226874 | 0.83 | NPC1 (0.78) | NPC1RAB9ACSNK2A2CSNK2BCSNK2A1 | |
| SCHEMBL26228005 | 0.80 | NPC1 (0.54) | NPC1RAB9ATNKSMEN1MAPT | |
| SCHEMBL30218603 | 0.80 | NPC1 (0.57) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL26227100 | 0.80 | NPC1 (0.57) | NPC1RAB9ATNKSCSNK2A1AKR1B1 | |
| SCHEMBL23903178 | 0.80 | NPC1 (0.60) | NPC1RAB9AMEN1MAPTKMT2A | |
| SCHEMBL26228170 | 0.79 | NPC1 (0.53) | NPC1RAB9ATNKSAKR1B1GABRP | |
| SCHEMBL26227038 | 0.78 | NPC1 (0.62) | NPC1RAB9ATNKSGABRPGABRD |
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 |
|---|---|---|---|---|---|---|---|
| EP-4126870-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | Merck Patent GmbH (DE) | 2023-02-08 | — | — | EP | disclosed |