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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8264195 | 0.73 | NPSR1 (0.33) | CA12CA1CA2CA9 | |
| Bromide SCHEMBL27444662 | 0.71 | LMNA (0.34) | — | |
| SCHEMBL27537600 | 0.69 | LMNA (0.35) | — | |
| SCHEMBL7483395 | 0.68 | — | — | |
| SCHEMBL27407554 | 0.67 | — | — | |
| SCHEMBL7048298 | 0.67 | HRH3 (0.36) | — | |
| SCHEMBL22268216 | 0.64 | — | — | |
| SCHEMBL12124475 | 0.63 | SLC6A2 (0.37) | — | |
| SCHEMBL22639006 | 0.60 | CA2 (0.35) | CA12CA1CA2CA9 | |
| SCHEMBL21291825 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1130876-A | Composition for preventing and treating helminth infection | PETROVAX L L C (US) | 1996-09-11 | — | — | CN | disclosed |