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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 2/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.39 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 4/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15775407 | 0.86 | CCNE2 (0.44) | GAAMAOBKDM4EKMT2AALDH1A1 | |
| Bromide SCHEMBL15775614 | 0.81 | GRM2 (0.40) | ADORA1ADORA2ATDO2MAOBKDM4E | |
| SCHEMBL15775665 | 0.80 | ALDH1A1 (0.40) | ADORA1ADORA2AGAAKDM4EALDH1A1 | |
| Bromide SCHEMBL15775497 | 0.79 | UGCG (0.40) | ADORA1ADORA2ANCOA1KDM4EKMT2A | |
| Bromide SCHEMBL15775462 | 0.78 | XDH (0.41) | MAOBIDO1 | |
| Bromide SCHEMBL15775859 | 0.78 | XDH (0.41) | ADORA1ADORA2AMAOBGRM5GRM1 | |
| SCHEMBL15775307 | 0.77 | UGCG (0.41) | ADORA1ADORA2ANCOA1KDM4EKMT2A | |
| SCHEMBL15775366 | 0.77 | RAB9A (0.38) | ADORA2AKDM4EKMT2AALDH1A1MEN1 | |
| Bromide SCHEMBL15775323 | 0.76 | TYR (0.41) | MAOBKDM4EKMT2AALDH1A1MEN1 | |
| Bromide SCHEMBL15775833 | 0.76 | RXFP1 (0.34) | ADORA1ADORA2AMAOBKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014087165-A1 | TANKYRASE INHIBITORS | UNIVERSITY OF BATH (GB) | 2014-06-12 | — | — | WO | disclosed |