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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 3/20 | 0.46 |
| ▸ | LAP3 | P28838 | 1/20 | 0.46 |
| ▸ | DPEP1 | P16444 | 5/20 | 0.38 |
| ▸ | ERAP2 | Q6P179 | 5/20 | 0.37 |
| ▸ | ERAP1 | Q9NZ08 | 3/20 | 0.37 |
| ▸ | IL1RN | P18510 | 2/20 | 0.37 |
| ▸ | LNPEP | Q9UIQ6 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7277423 | 0.99 | ANPEP (0.47) | ANPEPLAP3DPEP1ERAP2ERAP1 | |
| SCHEMBL9647220 | 0.85 | ANPEP (0.65) | ANPEPLAP3DPEP1ERAP2ERAP1 | |
| SCHEMBL9646994 | 0.75 | DPEP1 (0.49) | ANPEPLAP3DPEP1ERAP2METAP1 | |
| Hydrochloric Acid SCHEMBL10718561 | 0.75 | ACE2 (0.48) | ANPEPERAP2ERAP1LNPEPMMP1 | |
| SCHEMBL7283423 | 0.75 | ACE2 (0.60) | — | |
| SCHEMBL10715976 | 0.74 | DPEP1 (0.49) | ANPEPDPEP1ERAP2MMP1METAP1 | |
| Hydrochloric Acid SCHEMBL7283296 | 0.73 | DPEP1 (0.48) | ANPEPDPEP1ERAP2MMP1METAP1 | |
| Bromide SCHEMBL10716005 | 0.73 | CTSK (0.36) | MMP1 | |
| SCHEMBL7277428 | 0.71 | CTSK (0.37) | MMP1 | |
| SCHEMBL9645168 | 0.71 | METAP1 (0.54) | ANPEPLAP3DPEP1ERAP2METAP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0210545-A2 | Phosphorous containing enzyme inhibitors | MERCK & CO. INC. (US) | 1987-02-04 | — | — | EP | claimed |
| EP-0210545-A2 | Phosphorous containing enzyme inhibitors | MERCK & CO. INC. (US) | 1987-02-04 | — | — | EP | disclosed |