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 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ANPEP | P15144 | 5/20 | 0.66 |
| ▸ | RNPEP | Q9H4A4 | 4/20 | 0.66 |
| ▸ | DNPEP | Q9ULA0 | 4/20 | 0.66 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.44 |
| ▸ | LAP3 | P28838 | 3/20 | 0.44 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | RRM1 | P23921 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL14067667 | 0.98 | ANPEP (0.68) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| SCHEMBL1277891 | 0.98 | ANPEP (0.68) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| SCHEMBL1277892 | 0.98 | ANPEP (0.68) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| Hydrochloric Acid SCHEMBL1277930 | 0.96 | ANPEP (0.66) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| Bromide SCHEMBL7287179 | 0.88 | ANPEP (0.57) | ANPEPRNPEPDNPEPSLC7A5LAP3 | |
| SCHEMBL1769031 | 0.85 | SLC7A5 (0.59) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| SCHEMBL1769602 | 0.85 | SLC7A5 (0.59) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| SCHEMBL1768387 | 0.85 | SLC7A5 (0.59) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| SCHEMBL1769033 | 0.85 | SLC7A5 (0.59) | ANPEPRNPEPDNPEPSLC7A5DPP7 | |
| SCHEMBL9113004 | 0.84 | DPP7 (0.52) | ANPEPRNPEPDNPEPSLC7A5DPP7 |
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-5214056-A | Thiol protease inhibitors | JAPAN TOBACCO INC. (JP) | 1993-05-25 | — | — | US | disclosed |
| EP-0460239-A1 | 1,3,2-DIOXATHIOLANE OXIDE DERIVATIVE | Japan Tobacco Inc. (JP) | 1991-12-11 | — | — | EP | disclosed |