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 | |
|---|---|---|---|---|
| ▸ | F2R | P25116 | 13/20 | 0.81 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 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 SCHEMBL1730975 | 0.94 | F2R (0.72) | F2RSMN1; SMN2GAAMAPT | |
| Bromide SCHEMBL1729548 | 0.93 | F2R (0.93) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Bromide SCHEMBL5493294 | 0.90 | F2R (0.85) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Atopaxar SCHEMBL1728925 | 0.90 | F2R (1.00) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Atopaxar SCHEMBL30008036 | 0.90 | F2R (1.00) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Atopaxar SCHEMBL29904776 | 0.90 | F2R (1.00) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Bromide SCHEMBL1730058 | 0.89 | F2R (0.88) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Atopaxar SCHEMBL1730339 | 0.89 | F2R (1.00) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Atopaxar SCHEMBL30175034 | 0.89 | F2R (1.00) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA | |
| Atopaxar SCHEMBL1729065 | 0.88 | F2R (0.98) | F2RSMN1; SMN2ALDH1A1L3MBTL1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1391451-B1 | 2-IMINOPYRROLIDINE DERIVATES | EISAI R&D MAN CO LTD (JP) | 2011-11-23 | — | — | EP | disclosed |