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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | AADAT | Q8N5Z0 | 4/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | RECQL | P46063 | 2/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9906479 | 0.98 | — | — | |
| SCHEMBL5178410 | 0.98 | — | — | |
| Bromide SCHEMBL21747699 | 0.77 | TSHR (0.39) | CYP19A1KMT2ATSHRMAPT | |
| SCHEMBL84385 | 0.74 | TSHR (0.40) | CYP19A1KMT2ATSHRMAPT | |
| SCHEMBL19370778 | 0.74 | TSHR (0.40) | CYP19A1KMT2ATSHRMAPT | |
| SCHEMBL22876893 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL27139533 | 0.73 | TSHR (0.39) | CYP19A1KMT2ATSHRMAPT | |
| SCHEMBL22045856 | 0.72 | KMT2A (0.47) | CYP19A1KMT2ATSHRALDH1A1MAPT | |
| SCHEMBL19711770 | 0.72 | KMT2A (0.47) | CYP19A1KMT2ATSHRALDH1A1MAPT | |
| SCHEMBL14275838 | 0.72 | CYP19A1 (0.39) | CYP19A1KMT2ATSHRALDH1A1MAPT |
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-110582492-A | Substituted succinimide derivatives as pesticides | 巴斯夫欧洲公司 | 2019-12-17 | — | — | CN | disclosed |