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 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | MTOR | P42345 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | GRK2 | P25098 | 1/20 | 0.32 |
| ▸ | GRK3 | P35626 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8121179 | 0.83 | USP2 (0.55) | CYP19A1KCNN4USP2RAB9AKMT2A | |
| Bromide SCHEMBL7017406 | 0.82 | NOS3 (0.45) | CYP19A1KCNN4RAB9ALMNASMN1; SMN2 | |
| Bromide SCHEMBL8081397 | 0.78 | KIF11 (0.52) | USP2RAB9APTPN1KIF11 | |
| Bromide SCHEMBL7021518 | 0.73 | USP2 (0.36) | KCNN4USP2RAB9A | |
| SCHEMBL3362928 | 0.72 | KCNN4 (0.48) | CYP19A1KCNN4RAB9ANFE2L2CYP3A4 | |
| SCHEMBL6515165 | 0.71 | USP2 (0.37) | KCNN4USP2RAB9A | |
| Bromide SCHEMBL7019878 | 0.71 | NOS3 (0.49) | KCNN4USP2RAB9AKMT2A | |
| Bromide SCHEMBL7025852 | 0.71 | UHRF1 (0.35) | USP2RAB9ASMN1; SMN2TP53 | |
| SCHEMBL5643430 | 0.71 | KCNN4 (0.47) | CYP19A1KCNN4RAB9ANFE2L2CYP3A4 | |
| SCHEMBL4015306 | 0.70 | KCNN4 (0.50) | KCNN4RAB9ANFE2L2LMNASMN1; SMN2 |
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-1354603-A1 | CONCOMITANT DRUGS | Takeda Chemical Industries, Ltd. (JP) | 2003-10-22 | — | — | EP | disclosed |