Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | NQO2 | P16083 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9088658 | 0.86 | ALDH1A1 (0.47) | ALDH1A1F2RL3CCR1CCR5CCR8 | |
| SCHEMBL29481835 | 0.81 | CCR1 (0.36) | F2RL3CCR1CCR5CCR8NQO2 | |
| SCHEMBL9089178 | 0.79 | NQO2 (0.38) | F2RL3CCR1CCR5CCR8NQO2 | |
| SCHEMBL19783200 | 0.76 | NOS3 (0.37) | F2RL3CCR1CCR5CCR8NQO2 | |
| SCHEMBL19776431 | 0.76 | F2RL3 (0.44) | F2RL3 | |
| SCHEMBL31283693 | 0.76 | ALDH1A1 (0.39) | ALDH1A1F2RL3NQO2 | |
| SCHEMBL12225192 | 0.76 | ALDH1A1 (0.39) | ALDH1A1F2RL3NQO2 | |
| SCHEMBL9090122 | 0.75 | CCR1 (0.35) | F2RL3CCR1CCR5CCR8 | |
| SCHEMBL19775902 | 0.75 | NQO2 (0.32) | F2RL3CCR1CCR5CCR8NQO2 | |
| SCHEMBL19783137 | 0.73 | HDAC4 (0.33) | CCR1CCR5CCR8 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5491126-A | BENZOTRIAZINE DERIVATIVES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-02-13 | — | — | US | disclosed |
| US-5389600-A | A phenyl quinoxaline or benzotriazine antigrowth agents | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1995-02-14 | — | — | US | disclosed |
| EP-0559843-B1 | SUBSTITUTED N-HETEROBICYCLIC HERBICIDES | DU PONT (US) | 1994-09-14 | — | — | EP | disclosed |
| EP-0559843-A1 | SUBSTITUTED N-HETEROBICYCLIC HERBICIDES. | DU PONT (US) | 1993-09-15 | — | — | EP | disclosed |
| WO-1992009578-A1 | SUBSTITUTED FUSED HETEROCYCLIC HERBICIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-06-11 | — | — | WO | disclosed |
| US-5110347-A | Pre- and postemergence; quinoxaline derivatives | E. I DU PONT DE NEMOURS AND COMPANY (US) | 1992-05-05 | — | — | US | disclosed |