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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CAPN1 | P07384 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | SNCA | P37840 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 SCHEMBL8948916 | 1.00 | TSHR (0.36) | TSHRKMT2AALDH1A1LMNACAPN1 | |
| Bromide SCHEMBL3558232 | 0.80 | ALDH1A1 (0.53) | TSHRKMT2AALDH1A1LMNAKDM4E | |
| SCHEMBL7705763 | 0.77 | ALDH1A1 (0.42) | TSHRKMT2AALDH1A1LMNAHPGD | |
| SCHEMBL7705766 | 0.77 | ALDH1A1 (0.42) | TSHRKMT2AALDH1A1LMNAHPGD | |
| SCHEMBL8948983 | 0.77 | TSHR (0.42) | TSHRKMT2AALDH1A1LMNAHPGD | |
| SCHEMBL8948976 | 0.77 | TSHR (0.42) | TSHRKMT2AALDH1A1LMNAHPGD | |
| SCHEMBL10610585 | 0.77 | TSHR (0.42) | TSHRKMT2AALDH1A1LMNAHPGD | |
| Bromide SCHEMBL9486470 | 0.75 | KMT2A (0.35) | KMT2AALDH1A1LMNAHPGDKDM4E | |
| Bromide SCHEMBL9799361 | 0.75 | NFE2L2 (0.41) | KMT2AALDH1A1HPGDKDM4EHSD17B10 | |
| SCHEMBL10610893 | 0.74 | TSHR (0.42) | TSHRKMT2AALDH1A1LMNAHPGD |
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-5573999-A | FUNGICIDES AND INSECTICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1996-11-12 | — | — | US | disclosed |
| US-5538940-A | FUNGICIDE, MITICIDE, INSECTICIDE | BASF AKTIENGESELLSCHAFT (DE) | 1996-07-23 | — | — | US | disclosed |