Known targets — ChEMBL curated mechanism
ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4
The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 known ✓ | P08588 | 1/20 | 0.45 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 15/20 | 0.49 |
| ▸ | AHR | P35869 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9824743 | 0.98 | MAPKAPK2 (0.53) | MAPKAPK2GAAAHRKMT2ATDP1 | |
| Bromide SCHEMBL11199816 | 0.87 | CRBN (0.52) | MAPKAPK2ADRB1 | |
| SCHEMBL9096425 | 0.86 | GAA (0.55) | GAAAHRKMT2ATDP1MEN1 | |
| SCHEMBL7274510 | 0.85 | CRBN (0.53) | MAPKAPK2ADRB1 | |
| SCHEMBL9098720 | 0.84 | GAA (0.57) | GAAAHRKMT2ATDP1MEN1 | |
| SCHEMBL10081692 | 0.80 | GAA (0.73) | MAPKAPK2GAAKMT2ATDP1MEN1 | |
| SCHEMBL17006472 | 0.78 | PDE3B (0.49) | MAPKAPK2ADRB1 | |
| Bromide SCHEMBL11198697 | 0.78 | CRBN (0.52) | ADRB1 | |
| SCHEMBL26547684 | 0.77 | GAA (0.67) | GAAKMT2A | |
| SCHEMBL10080664 | 0.76 | GAA (0.75) | GAAKMT2ATDP1MEN1ADRB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0168003-B1 | OXINDOL COMPOUNDS, COMPOSITIONS CONTAINING SAME AND PROCESSES FOR PREPARING SAME | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1991-04-03 | — | — | EP | disclosed |
| US-4737501-A | Substituted piperazinyl oxindol compounds and cardiotonic compositions containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1988-04-12 | — | — | US | disclosed |
| EP-0168003-A1 | Oxindol compounds, compositions containing same and processes for preparing same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1986-01-15 | — | — | EP | disclosed |