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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 known ✓ | P49768 | 3/20 | 0.32 |
| ▸ | PSEN2 known ✓ | P49810 | 3/20 | 0.32 |
| ▸ | APH1B known ✓ | Q8WW43 | 3/20 | 0.32 |
| ▸ | NCSTN known ✓ | Q92542 | 3/20 | 0.32 |
| ▸ | APH1A known ✓ | Q96BI3 | 3/20 | 0.32 |
| ▸ | PSENEN known ✓ | Q9NZ42 | 3/20 | 0.32 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 2/20 | 0.32 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.32 |
| ▸ | GCGR | P47871 | 1/20 | 0.32 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.32 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| Bromide SCHEMBL7021518 | 0.84 | USP2 (0.36) | RAB9AUSP2MAPK13MAPK12MAPK11 | |
| SCHEMBL6515165 | 0.83 | USP2 (0.37) | RAB9AUSP2MAPK13MAPK12MAPK11 | |
| Bromide SCHEMBL7019878 | 0.82 | NOS3 (0.49) | RAB9AUSP2MAPK13MAPK12MAPK11 | |
| Bromide SCHEMBL8121179 | 0.79 | USP2 (0.55) | RAB9AUSP2GCGRMAPK14 | |
| SCHEMBL13564276 | 0.75 | UHRF1 (0.43) | UHRF1RAB9APSEN1PSEN2APH1B | |
| Bromide SCHEMBL7020460 | 0.72 | NOS3 (0.45) | MAPK14KDM4E | |
| SCHEMBL20703304 | 0.71 | SMN1; SMN2 (0.50) | RAB9AGCGRTP53NPC1SMN1; SMN2 | |
| Bromide SCHEMBL7180638 | 0.71 | CYP19A1 (0.39) | RAB9AUSP2TP53SMN1; SMN2 | |
| Bromide SCHEMBL7017406 | 0.70 | NOS3 (0.45) | RAB9APOLBNPC1SMN1; SMN2KDM4E | |
| SCHEMBL4015306 | 0.69 | KCNN4 (0.50) | RAB9APOLBNPC1SMN1; SMN2RORC |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268474-A2 | SUBSTITUTED 1,3-THIAZOLE COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001074811-A2 | SUBSTITUTED 1,3-THIAZOLE COMPOUNDS, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-10-11 | — | — | WO | disclosed |