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 | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.73 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.73 |
| ▸ | IAPP | P10997 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.50 |
| ▸ | EGFR | P00533 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CDK2 | P24941 | 1/20 | 0.50 |
| ▸ | MMP12 | P39900 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL70065 | 0.98 | GABRA1 (0.76) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| SCHEMBL30023472 | 0.98 | GABRA1 (0.76) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| Formaldehyde SCHEMBL27752499 | 0.93 | GABRA1 (0.70) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| SCHEMBL5967671 | 0.91 | GABRA1 (0.67) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| Bicarbonate SCHEMBL8910358 | 0.91 | GABRA1 (0.67) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| Phosphoric Acid SCHEMBL466514 | 0.89 | GABRA1 (0.64) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| Acetic Acid SCHEMBL29141185 | 0.89 | GABRA1 (0.64) | GABRA1GABRB2IAPPALDH1A1LMNA | |
| Glycolic Acid SCHEMBL28495550 | 0.86 | GABRA1 (0.59) | GABRA1GABRB2IAPP | |
| SCHEMBL199730 | 0.85 | GABRA1 (1.00) | GABRA1GABRB2IAPPCA2 | |
| Bromide SCHEMBL27499802 | 0.82 | IAPP (0.62) | GABRA1GABRB2IAPPALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0118974-A1 | 3,4-Dihydroxyphenyl ethyl amine derivatives and pharmaceutical compositions containing them | FISONS plc (GB) | 1984-09-19 | — | — | EP | disclosed |