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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 SCHEMBL9547206 | 0.78 | MCL1 (0.35) | TSHR | |
| Bromide SCHEMBL9547167 | 0.74 | SELP (0.35) | DNM1ALDH1A1 | |
| SCHEMBL13567367 | 0.72 | DNM1 (0.52) | TSHRDNM1 | |
| Hydrochloric Acid SCHEMBL10382215 | 0.70 | APEX1 (0.50) | TSHRDNM1ALDH1A1TDP1 | |
| Bromide SCHEMBL9547319 | 0.69 | CHRM5 (0.50) | TSHR | |
| SCHEMBL13567365 | 0.68 | MEN1 (0.39) | TSHRDNM1 | |
| SCHEMBL10257106 | 0.67 | TSHR (0.48) | TSHRALDH1A1TDP1 | |
| Bromide SCHEMBL11502784 | 0.67 | DNM1 (0.48) | TSHRDNM1ALDH1A1TDP1 | |
| SCHEMBL13627731 | 0.67 | DNM1 (0.56) | TSHRDNM1 | |
| Bromide SCHEMBL27777926 | 0.67 | DNM1 (0.71) | TSHRDNM1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993023402-A1 | 3-AZETIDINYLTHIO-CARBAPENEME DERIVATIVES, THEIR PREPARATION AND USE AS ANTIMICROBIAL AGENTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1993-11-25 | — | — | WO | disclosed |