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 | |
|---|---|---|---|---|
| ▸ | GGPS1 | O95749 | 3/20 | 0.47 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.45 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.38 |
| ▸ | KDM5A | P29375 | 6/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 6/20 | 0.36 |
| ▸ | PHF8 | Q9UPP1 | 2/20 | 0.36 |
| ▸ | KDM5C | P41229 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | KDM4A | O75164 | 2/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.32 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.32 |
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 SCHEMBL28555829 | 1.00 | GGPS1 (0.47) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Bromide SCHEMBL28465563 | 1.00 | GGPS1 (0.47) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Bromide SCHEMBL29001124 | 1.00 | GGPS1 (0.47) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Bromide SCHEMBL27976636 | 0.78 | GGPS1 (0.56) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Bromide SCHEMBL28407285 | 0.78 | GGPS1 (0.56) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Bromide SCHEMBL9575767 | 0.78 | GGPS1 (0.56) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Bromide SCHEMBL2858694 | 0.78 | GGPS1 (0.56) | GGPS1DNM1S1PR2S1PR1S1PR3 | |
| Hydrochloric Acid SCHEMBL4457576 | 0.77 | — | — | |
| SCHEMBL412250 | 0.76 | THRB (0.40) | — | |
| Bromide SCHEMBL28814064 | 0.76 | GGPS1 (0.55) | GGPS1DNM1S1PR2S1PR1S1PR3 |
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-112708066-A | Crosslinking air-entraining water reducer and preparation method thereof | 科之杰新材料集团有限公司 | 2021-04-27 | — | — | CN | disclosed |