Known targets — ChEMBL curated mechanism
ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1
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 | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MYC | P01106 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | HSPA1A | P0DMV8 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 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 | |
|---|---|---|---|---|
| SCHEMBL5327874 | 0.84 | CA12 (0.50) | CA12CA1CA2CA6CA9 | |
| Isophthalic Acid SCHEMBL28470879 | 0.74 | KMO (0.57) | CA12CA1CA2CA6CA9 | |
| Bromide SCHEMBL1502843 | 0.73 | ACHE (0.48) | ALDH1A1KDM4EMEN1GAAMAPT | |
| SCHEMBL142937 | 0.72 | PARP1 (0.65) | CA12CA1CA2CA6CA9 | |
| SCHEMBL29382709 | 0.72 | PARP1 (0.65) | CA12CA1CA2CA6CA9 | |
| SCHEMBL14406 | 0.72 | PARP1 (0.65) | CA12CA1CA2CA6CA9 | |
| Isophthalic Acid SCHEMBL19512128 | 0.72 | TPMT (0.65) | CA12CA1CA2CA6CA9 | |
| SCHEMBL5301154 | 0.71 | ACHE (0.50) | ALDH1A1KDM4EMEN1GAAMAPT | |
| SCHEMBL6916870 | 0.70 | PARP1 (0.63) | CA12CA1CA2CA6CA9 | |
| Isophthalic Acid SCHEMBL7159308 | 0.70 | PARP1 (0.57) | CA12CA1CA2CA6CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112040931-A | Excipient compounds for protein formulations | 改进生物制品有限责任公司 | 2020-12-04 | — | — | CN | disclosed |