Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 1/20 | 0.39 |
| ▸ | PGK1 | P00558 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | ENPP1 | P22413 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL9700631 | 0.83 | NQO2 (0.52) | NQO2PGK1KDM4EALDH1A1GLA | |
| SCHEMBL9700929 | 0.80 | GGPS1 (0.39) | PGK1 | |
| SCHEMBL9702005 | 0.77 | — | — | |
| SCHEMBL11487596 | 0.74 | NQO2 (0.46) | NQO2PGK1KDM4EALDH1A1GLA | |
| SCHEMBL11477391 | 0.74 | NQO2 (0.46) | NQO2PGK1KDM4EALDH1A1GLA | |
| SCHEMBL9746062 | 0.72 | MMP1 (0.36) | — | |
| SCHEMBL9701697 | 0.71 | ERBB2 (0.44) | NQO2KDM4EMAPT | |
| SCHEMBL11696562 | 0.70 | PDE4A (0.54) | NQO2PGK1KDM4EALDH1A1GLA | |
| SCHEMBL9699664 | 0.70 | MMP1 (0.41) | NQO2PGK1ALDH1A1 | |
| SCHEMBL15949820 | 0.69 | STING1 (0.49) | ALDH1A1GAAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1992014740-A1 | QUINOXALINE PHOSPHONO-AMINO ACIDS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-09-03 | — | — | WO | disclosed |
| US-5118675-A | Therapy for central nervous system disorders | AMERICAN HOME PRODUCTS CORPORATION (US) | 1992-06-02 | — | — | US | disclosed |