Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | KMO | O15229 | 2/20 | 0.60 |
| ▸ | RECQL | P46063 | 2/20 | 0.58 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5338764 | 0.89 | CYP1A2 (0.58) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL5389251 | 0.84 | RECQL (0.61) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL27997802 | 0.82 | RECQL (0.65) | CYP1A2KMORECQLDAOP2RX7 | |
| Bromide SCHEMBL15550565 | 0.82 | RECQL (0.59) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL20083662 | 0.81 | CYP1A2 (0.62) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL20083661 | 0.81 | CYP1A2 (0.62) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL731073 | 0.81 | CYP1A2 (0.62) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL5565705 | 0.81 | CYP1A2 (0.62) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL20083802 | 0.81 | CYP1A2 (0.62) | CYP1A2KMORECQLDAOP2RX7 | |
| SCHEMBL29947768 | 0.81 | CYP1A2 (0.62) | CYP1A2KMORECQLDAOP2RX7 |
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-0790241-A1 | COMPLEXONES WITH THE STRUCTURE OF N-2-(AZOL-1(2)-YL)ETHYLIMINODIACETIC ACIDS, SYNTHESIS, ANALYTICAL STUDY AND BIOLOGICAL APPLICATIONS | UNIVERSIDAD NACIONAL DE EDUCACION A DISTANCIA (ES) | 1997-08-20 | — | — | EP | disclosed |