Bromide

Bromide

SCHEMBL6289063

Cc1cc(C(=O)C[S+](C)C)ccc1N(C)C.[Br-]

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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
MAPT P10636 5/20 0.39
GAA P10253 2/20 0.39
MAPK1 P28482 1/20 0.39
HCAR3 P49019 2/20 0.38
ESR1 P03372 1/20 0.36
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
ALDH1A1 P00352 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HTT P42858 2/20 0.33
HPGD P15428 3/20 0.33
MAOA P21397 3/20 0.32
MAOB P27338 3/20 0.32
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
LMNA P02545 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
PIM1 P11309 1/20 0.31
POLB P06746 1/20 0.31

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 SCHEMBL6289562 0.75 ALDH1A1 (0.53) MAPTGAAMAPK1ALDH1A1MEN1
SCHEMBL15075229 0.74 MAPT (0.47) MAPTGAAMAPK1HCAR3ESR1
SCHEMBL2120103 0.74 HCAR3 (0.57) MAPTGAAMAPK1HCAR3ESR1
Bromide SCHEMBL6289517 0.73 KMT2A (0.49) MAPTALDH1A1KMT2AHPGDKDM4E
SCHEMBL3117262 0.73 GAA (0.50) MAPTGAAMAPK1HCAR3ESR1
SCHEMBL19354873 0.71 CA12 (0.56) MAPTMAPK1ESR1ALDH1A1MEN1
SCHEMBL23693239 0.70 GAA (0.50) MAPTGAAMAPK1HCAR3ESR1
SCHEMBL10355547 0.69 NPC1 (0.58) MAPTGAAMAPK1ALDH1A1MEN1
Bromide SCHEMBL6289071 0.69 ALDH1A1 (0.56) MAPTGAAMAPK1ALDH1A1MEN1
SCHEMBL10473157 0.69 KMT2A (0.42) MAPTGAAMAPK1HCAR3ESR1

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
US-6900250-B2 Polymerizable composition TOYO INK MFG. CO., LTD. (JP) 2005-05-31 US disclosed
US-20030212162-A1 Photopolymerization using photoinitiators TOYO INK MFG. CO., LTD. (JP) 2003-11-13 US disclosed