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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.84 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.84 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.69 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.68 |
| ▸ | SLC47A2 | Q86VL8 | 1/20 | 0.68 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.68 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | MTOR | P42345 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | RAD52 | P43351 | 1/20 | 0.57 |
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 SCHEMBL10409042 | 0.99 | KCNH2 (0.84) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL10591647 | 0.99 | KCNH2 (0.84) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL10409044 | 0.99 | KCNH2 (0.84) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL10591640 | 0.99 | KCNH2 (0.84) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| SCHEMBL13720309 | 0.99 | KCNH2 (0.86) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| SCHEMBL13851842 | 0.99 | KCNH2 (0.86) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL9643858 | 0.98 | KCNH2 (0.85) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL9643853 | 0.98 | KCNH2 (0.85) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL9643847 | 0.98 | KCNH2 (0.85) | KCNH2AGTR1HRH3SLC22A2SLC47A2 | |
| Bromide SCHEMBL9643525 | 0.94 | KCNH2 (0.77) | KCNH2AGTR1HRH3SLC22A2SLC47A2 |
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-0330253-A1 | Novel 16-homo-piperidino-androstane derivatives and processes for their preparation | AKZO N.V. (NL) | 1989-08-30 | — | — | EP | disclosed |