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 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 5/20 | 0.72 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.69 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1239368 | 0.97 | DNM1 (0.77) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL394062 | 0.93 | DNM1 (0.72) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| Iodide SCHEMBL5088044 | 0.93 | DNM1 (0.72) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| Fluoride Ion SCHEMBL31559159 | 0.93 | DNM1 (0.72) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| Bromide SCHEMBL622840 | 0.93 | DNM1 (0.78) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| Water SCHEMBL999491 | 0.93 | DNM1 (0.72) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| SCHEMBL17800111 | 0.93 | DNM1 (0.72) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| SCHEMBL346989 | 0.90 | SLC22A1 (0.73) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| SCHEMBL28793843 | 0.90 | SLC22A1 (0.73) | DNM1SLC22A1SLC22A2TSHRALDH1A1 | |
| SCHEMBL3876642 | 0.90 | SLC22A1 (0.73) | DNM1SLC22A1SLC22A2TSHRALDH1A1 |
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-4780558-A | CHEMICAL INTERMEDIATES FOR STILBENE FLUORESCENT WHITENING AGENTS | CIBA-GEIGY CORPORATION (US) | 1988-10-25 | — | — | US | disclosed |