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 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C known ✓ | P18825 | 1/20 | 0.65 |
| ▸ | CYP11B1 | P15538 | 12/20 | 0.69 |
| ▸ | CYP11B2 | P19099 | 10/20 | 0.69 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.63 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | QPCT | Q16769 | 1/20 | 0.62 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.62 |
| ▸ | QPCTL | Q9NXS2 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL10997898 | 0.98 | CYP11B1 (0.71) | CYP11B1CYP11B2ADRA2CCYP19A1TBXAS1 | |
| SCHEMBL394308 | 0.86 | CYP11B1 (0.83) | CYP11B1CYP11B2ADRA2CCYP19A1TBXAS1 | |
| SCHEMBL3092795 | 0.82 | CYP11B1 (1.00) | CYP11B1CYP11B2ADRA2CCYP19A1TBXAS1 | |
| SCHEMBL31158253 | 0.82 | CYP11B1 (0.70) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL5761382 | 0.80 | CYP19A1 (0.56) | CYP11B1CYP11B2CYP19A1TBXAS1 | |
| Bromide SCHEMBL10849755 | 0.80 | CYP19A1 (0.77) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| Benzylimidazole SCHEMBL16237308 | 0.79 | CYP11B1 (0.96) | CYP11B1CYP11B2CYP19A1TBXAS1CYP1A2 | |
| SCHEMBL5759374 | 0.79 | HMOX1 (0.57) | CYP11B1CYP11B2CYP19A1TBXAS1 | |
| SCHEMBL24733003 | 0.79 | CYP11B1 (0.71) | CYP11B1CYP11B2ADRA2CCYP19A1TBXAS1 | |
| SCHEMBL12205 | 0.79 | CYP11B1 (1.00) | CYP11B1CYP11B2ADRA2CCYP19A1TBXAS1 |
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-4555516-A | FOR TREATMENT OF CARDIOVASCULAR DISORDERS | PFIZER INC. (US) | 1985-11-26 | — | — | US | disclosed |
| US-4448781-A | CARDIOVASCULAR DISORDERS | PFIZER INC. (US) | 1984-05-15 | — | — | US | disclosed |