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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 1/20 | 0.35 |
| ▸ | HTR1A known ✓ | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A known ✓ | P08913 | 1/20 | 0.35 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL166842 | 0.97 | ALDH1A1 (0.58) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| SCHEMBL15421392 | 0.95 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Hydrochloric Acid SCHEMBL11345531 | 0.95 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Fluoride SCHEMBL634220 | 0.95 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Hydrochloric Acid SCHEMBL10880852 | 0.95 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Hydrazine SCHEMBL28217980 | 0.93 | ALDH1A1 (0.56) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| Bromide SCHEMBL10889011 | 0.93 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| SCHEMBL20246674 | 0.93 | ALDH1A1 (0.54) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| SCHEMBL9407479 | 0.89 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRTDP1CA2 | |
| SCHEMBL8862304 | 0.89 | ALDH1A1 (0.50) | ALDH1A1CYP3A4TSHRTDP1CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4254092-A | Method for separating hydrogen chloride and hydrogen bromide | CHEMISCHE WERKE HULS AG (DE) | 1981-03-03 | — | — | US | claimed |
| US-4582929-A | Method of recovering halide values from carbonylation reaction mixtures | THE DOW CHEMICAL COMPANY (US) | 1986-04-15 | — | — | US | disclosed |
| US-4254092-A | Method for separating hydrogen chloride and hydrogen bromide | CHEMISCHE WERKE HULS AG (DE) | 1981-03-03 | — | — | US | disclosed |
| EP-0008330-A1 | Process for the separation of hydrogen chloride and hydrogen bromine | CHEMISCHE WERKE HÜLS AG (DE) | 1980-03-05 | — | — | EP | disclosed |