Bromide

Bromide

SCHEMBL8520491

Br.O=[N+]([O-])c1ccc2[nH]ncc2c1

nearest known ligand 0.97

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 20)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 5/20 0.97
MAPT P10636 4/20 0.97
POLB P06746 1/20 0.97
MAOB P27338 1/20 0.97
CYP3A4 P08684 2/20 0.73
LMNA P02545 1/20 0.73
ALOX15 P16050 1/20 0.73
ROCK2 O75116 3/20 0.50
ROCK1 Q13464 3/20 0.50
ALDH1A1 P00352 3/20 0.49
HPGD P15428 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
METAP2 P50579 1/20 0.49
CSNK2A1 P68400 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
HIF1A Q16665 1/20 0.49

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
SCHEMBL148826 0.98 NOS1 (1.00) NOS1MAPTPOLBMAOBCYP3A4
Hydrochloric Acid SCHEMBL31587195 0.97 NOS1 (0.97) NOS1MAPTPOLBMAOBCYP3A4
Formaldehyde SCHEMBL29009556 0.95 NOS1 (0.93) NOS1MAPTPOLBMAOBCYP3A4
Indazole SCHEMBL27786912 0.91 NOS1 (0.85) NOS1MAPTPOLBMAOBCYP3A4
SCHEMBL17291792 0.89 NOS1 (0.82) NOS1MAPTPOLBMAOBCYP3A4
SCHEMBL29394925 0.84 MAPT (1.00) NOS1MAPTPOLBMAOBCYP3A4
SCHEMBL271522 0.84 MAPT (1.00) NOS1MAPTPOLBMAOBCYP3A4
SCHEMBL26630251 0.83 NOS1 (0.72) NOS1MAPTPOLBMAOBCYP3A4
Tert-Butyl Formate SCHEMBL27634816 0.83 NOS1 (0.72) NOS1MAPTPOLBMAOBCYP3A4
SCHEMBL27671367 0.83 MAPT (0.97) NOS1MAPTPOLBMAOBCYP3A4

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
US-5942380-A AQUEOUS SOLUTION OF AN ALKANOLAMINE, QUATERNARY AMMONIUM SALT, ALKALI RESISTANT WETTING AGENT, AND A NITROINDAZOLE ANTIFOGGING AGENT; FOR DEVELOPING SILVER HALIDE PRODUCTS, GRAPHIC ART FILMS HAVING HIGH CONTRAST EASTMAN KODAK COMPANY (US) 1999-08-24 US disclosed