Bromide

Bromide

SCHEMBL28648396

Br.NCCC(O)c1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

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 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.45
SLC6A4 known ✓ P31645 1/20 0.45
SLC6A3 known ✓ Q01959 1/20 0.45
HRH1 P35367 2/20 0.60
RIPK1 Q13546 1/20 0.53
LMNA P02545 1/20 0.52
AOC3 Q16853 5/20 0.52
HTR2A P28223 2/20 0.50
KDM4E B2RXH2 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TAAR1 Q96RJ0 1/20 0.46
BCAT2 O15382 1/20 0.46

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL3179795 0.98 HRH1 (0.62) HRH1RIPK1LMNAAOC3HTR2A
SCHEMBL42066 0.98 HRH1 (0.62) HRH1RIPK1LMNAAOC3HTR2A
SCHEMBL232834 0.98 HRH1 (0.62) HRH1RIPK1LMNAAOC3HTR2A
Hydrochloric Acid SCHEMBL4374172 0.95 HRH1 (0.60) HRH1RIPK1LMNAAOC3HTR2A
SCHEMBL27928248 0.95 HRH1 (0.60) HRH1RIPK1LMNAAOC3HTR2A
Hydrochloric Acid SCHEMBL16032107 0.95 HRH1 (0.60) HRH1RIPK1LMNAAOC3HTR2A
SCHEMBL4281797 0.86 HRH1 (0.68) HRH1RIPK1LMNAAOC3HTR2A
SCHEMBL7417534 0.86 HRH1 (0.68) HRH1RIPK1LMNAAOC3HTR2A
Cadaverine Tartrate SCHEMBL9851431 0.86 HRH1 (0.50) HRH1RIPK1LMNAAOC3HTR2A
Hydrochloric Acid SCHEMBL326015 0.84 HRH1 (0.65) HRH1RIPK1LMNAAOC3HTR2A

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113543752-A Multi-dose ophthalmic fluid delivery system 科达莱昂治疗公司 2021-10-22 CN disclosed