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 | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 1/20 | 0.45 |
| ▸ | KMT5B | Q4FZB7 | 2/20 | 0.68 |
| ▸ | KMT5C | Q86Y97 | 2/20 | 0.68 |
| ▸ | NSD2 | O96028 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL8834842 | 1.00 | KMT5B (0.68) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| SCHEMBL8541441 | 0.99 | KMT5B (0.70) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| SCHEMBL8541437 | 0.99 | KMT5B (0.70) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| SCHEMBL12634155 | 0.91 | KMT5B (0.78) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL1876988 | 0.90 | KMT5B (0.76) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL23360242 | 0.88 | KMT5B (0.54) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL23360239 | 0.88 | KMT5B (0.54) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| SCHEMBL6872111 | 0.84 | KMT5B (0.89) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| SCHEMBL7207215 | 0.84 | KMT5B (0.89) | KMT5BKMT5CNSD2KMT2AMEN1 | |
| SCHEMBL6872121 | 0.84 | KMT5B (0.89) | KMT5BKMT5CNSD2KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5596002-A | TREATMENT OF ANTIBIOTIC RESISTANT MICROORGANISMS | HOFFMANN-LA ROCHE INC. (US) | 1997-01-21 | — | — | US | disclosed |