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 | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 5/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.62 |
| ▸ | IDO1 | P14902 | 10/20 | 0.61 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.61 |
| ▸ | LMNA | P02545 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | SLC11A2 | P49281 | 2/20 | 0.61 |
| ▸ | NOS1 | P29475 | 2/20 | 0.56 |
| ▸ | NOS3 | P29474 | 1/20 | 0.55 |
| ▸ | NOS2 | P35228 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.50 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.50 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.50 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.50 |
| ▸ | ATP1A2 | P50993 | 1/20 | 0.50 |
| ▸ | ATP1B3 | P54709 | 1/20 | 0.50 |
| ▸ | FXYD2 | P54710 | 1/20 | 0.50 |
| ▸ | ATP1A4 | Q13733 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3690551 | 0.98 | HTT (0.65) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4018130 | 0.90 | HTT (0.57) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL3686933 | 0.89 | MAPT (0.59) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL3684767 | 0.88 | HTT (0.59) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL2810146 | 0.87 | IDO1 (0.71) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4016347 | 0.87 | NOS1 (0.60) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL14068776 | 0.86 | MAPT (0.61) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL3691297 | 0.85 | NOS1 (0.62) | HTTHPGDIDO1TAAR1LMNA | |
| SCHEMBL2812696 | 0.85 | IDO1 (0.74) | HTTHPGDIDO1TAAR1LMNA | |
| Bromide SCHEMBL4017471 | 0.84 | HTT (0.51) | HTTHPGDIDO1TAAR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-2061754-A1 | BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008115999-A1 | BIARYL AND BIHETEROARYL COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2008-09-25 | — | — | WO | disclosed |