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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHPS | P49366 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11060772 | 1.00 | DHPS (0.48) | DHPSMEN1KMT2ACYP1A2ALOX15 | |
| SCHEMBL11057119 | 0.97 | CYP1A2 (0.46) | DHPSMEN1KMT2ACYP1A2ALOX15 | |
| SCHEMBL11056365 | 0.90 | CYP1A2 (0.39) | DHPSMEN1KMT2ACYP1A2ALOX15 | |
| Bromide SCHEMBL17799781 | 0.89 | MIF (0.44) | DHPSMEN1KMT2ACYP1A2ALOX15 | |
| SCHEMBL11038146 | 0.87 | MEN1 (0.67) | DHPSMEN1KMT2ACYP1A2 | |
| SCHEMBL11039593 | 0.87 | MEN1 (0.67) | DHPSMEN1KMT2ACYP1A2 | |
| Bromide SCHEMBL11045675 | 0.87 | MEN1 (0.67) | DHPSMEN1KMT2ACYP1A2 | |
| Bromide SCHEMBL8820343 | 0.86 | CYP1A2 (0.64) | DHPSCYP1A2ALOX15NFKB1MAOA | |
| SCHEMBL7130947 | 0.84 | — | — | |
| SCHEMBL11060352 | 0.83 | CYP1A2 (0.30) | CYP1A2ALOX15NFKB1MAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997048705-A1 | POTASSIUM CHANNEL BLOCKERS | UNIVERSITY COLLEGE LONDON (GB) | 1997-12-24 | — | — | WO | disclosed |