Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 5/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 4/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL8817183 | 0.88 | NQO2 (0.40) | KEAP1NFE2L2MRGPRX4NPSR1NPC1 | |
| SCHEMBL3286247 | 0.87 | KEAP1 (0.43) | KEAP1NFE2L2PTPN1MEN1POLB | |
| SCHEMBL6140114 | 0.81 | AR (0.39) | NPC1RAB9ASMN1; SMN2L3MBTL1MTNR1A | |
| SCHEMBL6139688 | 0.76 | CYP19A1 (0.45) | KEAP1NFE2L2MAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL3287375 | 0.75 | KEAP1 (0.42) | KEAP1NFE2L2NPSR1MAPTSMN1; SMN2 | |
| SCHEMBL7467733 | 0.73 | CYP19A1 (0.44) | MAPTSMN1; SMN2L3MBTL1CYP19A1 | |
| SCHEMBL5264076 | 0.72 | KEAP1 (0.40) | KEAP1NFE2L2MEN1KMT2A | |
| SCHEMBL3289538 | 0.72 | KEAP1 (0.40) | KEAP1NFE2L2MEN1KMT2A | |
| SCHEMBL3142761 | 0.71 | MEN1 (0.40) | MAPTSMN1; SMN2MEN1KMT2ACYP19A1 | |
| SCHEMBL5203422 | 0.71 | MEN1 (0.40) | MAPTSMN1; SMN2MEN1KMT2ACYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997034905-A1 | PHOSPHORUS CONTAINING ARYLOXY AND ARYLTHIOPROPANOL AMINE DERIVATIVES USEFUL AS BETA ADRENORECEPTOR AGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1997-09-25 | — | — | WO | disclosed |