Bromide

Bromide

SCHEMBL30522158

Br.Br.Br.CN1CCN(c2ccc3[nH]c(-c4ccc5nc(-c6ccc(OCCCCC(=O)O)cc6)[nH]c5c4)nc3c2)CC1

nearest known ligand 0.65

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
ALDH1A1 P00352 4/20 0.65
SMN1; SMN2 Q16637 3/20 0.65
MAPT P10636 2/20 0.65
MEN1 O00255 1/20 0.65
SLCO2B1 O94956 1/20 0.65
GLA P06280 1/20 0.65
RECQL P46063 1/20 0.65
BLM P54132 1/20 0.65
KMT2A Q03164 1/20 0.65
BCL2L1 Q07817 1/20 0.65
SLCO1B3 Q9NPD5 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
SLCO1B1 Q9Y6L6 1/20 0.65
TOP1 P11387 3/20 0.61
TOP2A P11388 3/20 0.61
HPGD P15428 1/20 0.57
HSD17B10 Q99714 1/20 0.57
HDAC3 O15379 4/20 0.54
HDAC4 P56524 4/20 0.54
HDAC1 Q13547 4/20 0.54

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
Bromide SCHEMBL25436047 1.00 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL24299745 0.99 ALDH1A1 (0.66) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL24299754 0.92 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL16552182 0.91 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL22854292 0.91 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL25436540 0.90 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL23482780 0.88 ALDH1A1 (0.74) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL23191099 0.88 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
Trifluoroacetic Acid SCHEMBL29412254 0.87 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1
SCHEMBL24299746 0.87 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2MAPTMEN1SLCO2B1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4486924-A2 NUCLEIC ACID CROSSLINKING REAGENTS AND USES THEREOF Promega Corporation (US) 2025-01-08 EP disclosed
WO-2023177976-A2 NUCLEIC ACID CROSSLINKING REAGENTS AND USES THEREOF PROMEGA CORPORATION (US) 2023-09-21 WO disclosed
EP-4208564-A1 NUCLEIC ACID MODIFYING REAGENTS AND USES THEREOF Promega Corporation (US) 2023-07-12 EP disclosed