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 | |
|---|---|---|---|---|
| ▸ | GABRB3 | P28472 | 18/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 11/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 11/20 | 0.38 |
| ▸ | GABRP | O00591 | 5/20 | 0.38 |
| ▸ | GABRD | O14764 | 5/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 5/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 5/20 | 0.38 |
| ▸ | GABRA5 | P31644 | 5/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 5/20 | 0.38 |
| ▸ | GABRA4 | P48169 | 5/20 | 0.38 |
| ▸ | GABRE | P78334 | 5/20 | 0.38 |
| ▸ | GABRA6 | Q16445 | 5/20 | 0.38 |
| ▸ | GABRG1 | Q8N1C3 | 5/20 | 0.38 |
| ▸ | GABRG3 | Q99928 | 5/20 | 0.38 |
| ▸ | GABRQ | Q9UN88 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 SCHEMBL9309729 | 0.88 | RXRA (0.34) | KDM4EALDH1A1 | |
| Bromide SCHEMBL9309032 | 0.86 | KDM4E (0.41) | KDM4EALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL9311162 | 0.80 | GABRB3 (0.43) | GABRB3GABRA2GABRB2GABRPGABRD | |
| SCHEMBL10557714 | 0.76 | GABRB3 (0.47) | GABRB3GABRA2GABRB2GABRPGABRD | |
| SCHEMBL8026458 | 0.74 | GABRA2 (0.54) | GABRB3GABRA2GABRB2GABRPGABRD | |
| SCHEMBL9310110 | 0.74 | GABRB3 (0.48) | GABRB3GABRA2GABRB2GABRPGABRD | |
| SCHEMBL10769810 | 0.74 | GABRB3 (0.45) | GABRB3GABRA2GABRB2GABRPGABRD | |
| SCHEMBL10848533 | 0.73 | GABRA2 (0.53) | GABRB3GABRA2GABRB2GABRPGABRD | |
| SCHEMBL9309082 | 0.72 | GABRB3 (0.44) | GABRB3GABRA2GABRB2GABRPGABRD | |
| Hydrochloric Acid SCHEMBL9308796 | 0.71 | GABRB3 (0.43) | GABRB3GABRA2GABRB2GABRPGABRD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5321002-A | Herbicidal derivatives of 2-(1-aryl-4-cyano-5-pyrazolylmethyleneiminooxy)alkanoic acids | FMC CORPORATION (US) | 1994-06-14 | — | — | US | disclosed |
| US-5250504-A | Pre- and postemergence | FMC CORPORATION (US) | 1993-10-05 | — | — | US | disclosed |