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 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 known ✓ | Q99720 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.32 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL277412 | 0.98 | — | — | |
| SCHEMBL31550503 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL28011824 | 0.96 | SIGMAR1 (0.40) | SIGMAR1CHRNB2CHRNA4CTSDPDE3B | |
| SCHEMBL30423355 | 0.96 | SIGMAR1 (0.40) | SIGMAR1CHRNB2CHRNA4CTSDPDE3B | |
| SCHEMBL2853230 | 0.80 | — | — | |
| SCHEMBL29704485 | 0.80 | — | — | |
| Iodide SCHEMBL27382621 | 0.78 | SIGMAR1 (0.40) | SIGMAR1CHRNB2CHRNA4PDE3BPDE3A | |
| SCHEMBL27943278 | 0.78 | — | — | |
| SCHEMBL31326617 | 0.77 | SIGMAR1 (0.43) | SIGMAR1CHRNB2CHRNA4CTSD | |
| SCHEMBL31281120 | 0.77 | — | — |
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-112424188-A | Pyridazinones as PARP7 inhibitors | 里邦医疗公司 | 2021-02-26 | — | — | CN | disclosed |