Bromide

Bromide

SCHEMBL27298210

Br.Oc1ccc(-c2ccc3cc[nH]c3c2)cc1

nearest known ligand 0.68

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
TYR P14679 1/20 0.68
USP2 O75604 1/20 0.52
GAA P10253 1/20 0.52
ALOX15 P16050 1/20 0.52
RAD51 Q06609 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
FGFR1 P11362 2/20 0.51
FGFR2 P21802 2/20 0.51
FGFR3 P22607 2/20 0.51
ESR1 P03372 4/20 0.50
ESR2 Q92731 3/20 0.50
RIPK1 Q13546 1/20 0.49
BACE1 P56817 1/20 0.48
ENPP2 Q13822 2/20 0.47
NPC1 O15118 1/20 0.47
AHR P35869 3/20 0.47
CMA1 P23946 1/20 0.47
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 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
SCHEMBL1225643 0.98 TYR (0.70) TYRUSP2GAAALOX15RAD51
Hydrochloric Acid SCHEMBL27297304 0.96 TYR (0.68) TYRUSP2GAAALOX15RAD51
SCHEMBL3334895 0.87 TYR (0.71) TYRUSP2GAAALOX15RAD51
SCHEMBL27500072 0.82 USP2 (0.70) TYRUSP2GAAALOX15RAD51
SCHEMBL34240 0.81 TYR (1.00) TYRUSP2GAAALOX15RAD51
SCHEMBL29355861 0.81 TYR (1.00) TYRUSP2GAAALOX15RAD51
SCHEMBL30253604 0.80 NPC1 (0.71) TYRFGFR1ENPP2NPC1AHR
SCHEMBL443799 0.80 NPC1 (0.71) TYRFGFR1ENPP2NPC1AHR
SCHEMBL147946 0.78 AHR (0.70) TYRESR1ENPP2NPC1AHR
SCHEMBL13115618 0.78 BRD4 (0.53) TYRESR1ENPP2NPC1AHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1037510-C Indole derivatives HOFFMANN LA ROCHE (CH) 1998-02-25 CN disclosed
CN-1088576-A Indole derivatives HOFFMANN LA ROCHE (CH) 1994-06-29 CN disclosed