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 | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.53 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.53 |
| ▸ | HTR3A known ✓ | P46098 | 1/20 | 0.43 |
| ▸ | QDPR | P09417 | 3/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.50 |
| ▸ | DRD3 | P35462 | 1/20 | 0.50 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11208701 | 0.98 | QDPR (0.66) | QDPRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL5792003 | 0.89 | QDPR (0.79) | QDPRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13093266 | 0.89 | QDPR (0.79) | QDPRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| Bromide SCHEMBL4031386 | 0.85 | CYP2D6 (0.49) | QDPRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27635029 | 0.83 | CYP2D6 (0.50) | QDPRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL15650583 | 0.82 | CYP2D6 (0.49) | QDPRCYP2D6SLC6A2SLC6A4SLC6A3 | |
| Bromide SCHEMBL567414 | 0.80 | HTR3A (0.52) | CYP2D6SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL14632138 | 0.80 | HTR2A (0.65) | QDPRHTR2A | |
| SCHEMBL1291751 | 0.79 | QDPR (0.68) | QDPRACMSD | |
| SCHEMBL28188871 | 0.79 | QDPR (0.68) | QDPRCYP2D6ACMSD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4046901-A | HYPOTENSIVE AGENTS | ROUSSEL-UCLAF (FR) | 1977-09-06 | — | — | US | claimed |
| US-4046901-A | HYPOTENSIVE AGENTS | ROUSSEL-UCLAF (FR) | 1977-09-06 | — | — | US | disclosed |