Bromide

Bromide

SCHEMBL1596774

Br.O=C(O)c1ccc(CCl)cc1

nearest known ligand 0.61

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
CA1 P00915 4/20 0.61
CA2 P00918 4/20 0.61
ALDH1A1 P00352 4/20 0.58
TSHR P16473 3/20 0.57
TP53 P04637 1/20 0.57
ALOX15 P16050 1/20 0.52
KMT2A Q03164 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
KDM4E B2RXH2 1/20 0.52
MEN1 O00255 1/20 0.52
USP2 O75604 1/20 0.52
POLB P06746 1/20 0.52
GAA P10253 1/20 0.52
MAPT P10636 1/20 0.52
THRB P10828 1/20 0.52
NR4A1 P22736 1/20 0.52
APEX1 P27695 1/20 0.52
APOBEC3A P31941 1/20 0.52
RECQL P46063 1/20 0.52
HIF1A Q16665 1/20 0.52

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
SCHEMBL40281 0.98 CA1 (0.64) CA1CA2ALDH1A1TSHRTP53
SCHEMBL27700157 0.98 CA1 (0.64) CA1CA2ALDH1A1TSHRTP53
Hydrochloric Acid SCHEMBL1597978 0.95 CA1 (0.61) CA1CA2ALDH1A1TSHRTP53
SCHEMBL8029236 0.95 CA1 (0.61) CA1CA2ALDH1A1TSHRTP53
Ammonia Solution, Strong SCHEMBL29216630 0.95 CA1 (0.61) CA1CA2ALDH1A1TSHRTP53
SCHEMBL8023913 0.95 CA1 (0.61) CA1CA2ALDH1A1TSHRTP53
SCHEMBL28111598 0.93 CA1 (0.59) CA1CA2ALDH1A1TSHRTP53
SCHEMBL3618354 0.87 CA1 (0.53) CA1CA2ALDH1A1TSHRTP53
Benzamide SCHEMBL5499602 0.82 PLA2G10 (0.59) CA1CA2ALDH1A1TSHRPOLB
SCHEMBL9828068 0.82 CA1 (0.53) CA1CA2ALDH1A1TSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1780224-B1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO (JP) 2015-02-18 EP disclosed
US-8710165-B2 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2014-04-29 US disclosed
US-20110152388-A1 Multibranched polymer and method for producing the same NIPPON SODA CO., LTD. (JP) 2011-06-23 US disclosed
US-7919570-B2 narrowly dispersed; controlled molecular weight; ionic conductivity, shape stability; battery adhesive or binder; 1,1,2,2-tetrakis(4-hydroxyphenyl)ethane or pentaerythritol reacted with bromoisobutyroyl bromide for core; living radical polymerization of acrylate or a styrene at halogen atoms as the arms NIPPON SODA CO., LTD. (JP) 2011-04-05 US disclosed
US-20080214685-A1 Multibrached Polymer and Method for Producing the Same NIPPON SODA CO., LTD. (JP) 2008-09-04 US disclosed
EP-1780224-A1 MULTIBRANCHED POLYMERS AND PROCESS FOR PRODUCTION THEREOF NIPPON SODA CO., LTD. (JP) 2007-05-02 EP disclosed