Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | GLA | P06280 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28592462 | 1.00 | NPC1 (0.52) | NPC1RAB9AMEN1KMT2APTGS1 | |
| SCHEMBL17817812 | 0.90 | NPC1 (0.49) | NPC1RAB9AMEN1KMT2APTGS1 | |
| SCHEMBL17049367 | 0.78 | CCR5 (0.56) | RAB9AALDH1A1LMNAPTGER1CYP2C9 | |
| SCHEMBL23824777 | 0.78 | MAPT (0.54) | NPC1RAB9AMEN1KMT2APTGS1 | |
| SCHEMBL19830905 | 0.77 | SNCA (0.46) | NPC1RAB9AMEN1KMT2APTGS1 | |
| SCHEMBL30835066 | 0.77 | SNCA (0.46) | NPC1RAB9AMEN1KMT2APTGS1 | |
| SCHEMBL19830913 | 0.77 | KDM4E (0.41) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL2481443 | 0.76 | KDM4E (0.56) | NPC1RAB9AMEN1KMT2APTGS1 | |
| SCHEMBL12797471 | 0.76 | MAPT (0.54) | NPC1RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL29066107 | 0.75 | KDM4E (0.62) | NPC1RAB9AMEN1KMT2AKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-112961102-B | Metal complex and electron transport material using the same | 大电株式会社 | 2024-03-12 | — | — | CN | disclosed |