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 | |
|---|---|---|---|---|
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.46 |
| ▸ | ADRA1A known ✓ | P35348 | 1/20 | 0.46 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.46 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.50 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.45 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.41 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
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 SCHEMBL10570960 | 0.91 | KDM4C (0.47) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Bromide SCHEMBL10571104 | 0.86 | FOLH1 (0.49) | DNM1CHRM1AKR1A1CHRM3HTR2A | |
| Hydrochloric Acid SCHEMBL10570882 | 0.86 | DNM1 (0.52) | DNM1GPR84CA2MAPK1 | |
| Dymanthine SCHEMBL10575546 | 0.86 | DNM1 (0.52) | DNM1GPR84CA2MAPK1 | |
| Fluoride SCHEMBL10571718 | 0.83 | FOLH1 (0.49) | DNM1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL17511725 | 0.82 | DNM1 (0.56) | DNM1CHRM1AKR1A1CHRM3HTR2A | |
| SCHEMBL15900054 | 0.81 | FOLH1 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL9099935 | 0.79 | GPR84 (0.62) | GPR84FOLH1CA2MAPK1GRIK1 | |
| SCHEMBL338054 | 0.79 | GPR84 (0.62) | GPR84FOLH1CA2MAPK1GRIK1 | |
| SCHEMBL67580 | 0.79 | GPR84 (0.62) | GPR84FOLH1CA2MAPK1GRIK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4883917-A | Quaternary ammonium compounds | ETHYL CORPORATION (US) | 1989-11-28 | — | — | US | disclosed |