Bromide

Bromide

SCHEMBL9934306

Br.C=CCN(CC=C)C(CC)c1ccccc1

nearest known ligand 0.38

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 14)

geneUniProtsupporting neighboursconfidence
SIGMAR1 known ✓ Q99720 1/20 0.36
HTR2A P28223 3/20 0.38
HRH1 P35367 3/20 0.38
LMNA P02545 2/20 0.38
TDP1 Q9NUW8 1/20 0.37
TRPM8 Q7Z2W7 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
CYP2C19 P33261 1/20 0.36
AOC3 Q16853 1/20 0.34
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL11870472 0.98 HTR2A (0.39) HTR2AHRH1LMNATDP1TRPM8
Hydrochloric Acid SCHEMBL9934286 0.96 TDP1 (0.41) HTR2AHRH1LMNATDP1TRPM8
Iodide SCHEMBL9933723 0.96 HTR2A (0.38) HTR2AHRH1LMNATDP1TRPM8
SCHEMBL9934658 0.84 RAB9A (0.38) LMNATDP1TRPM8SMN1; SMN2CYP2C19
SCHEMBL22073549 0.82 HTR2A (0.38) HTR2AHRH1LMNATDP1TRPM8
SCHEMBL15389921 0.82 SMN1; SMN2 (0.34) LMNATDP1TRPM8SMN1; SMN2CYP2C19
Bromide SCHEMBL29141692 0.81 SIGMAR1 (0.41) HTR2AHRH1SIGMAR1MEN1KMT2A
Hydrochloric Acid SCHEMBL17364017 0.81 TDP1 (0.40) HTR2AHRH1LMNATDP1TRPM8
SCHEMBL6391998 0.80 CYP2C19 (0.41) HTR2AHRH1TDP1SMN1; SMN2CYP2C19
SCHEMBL6391995 0.80 CYP2C19 (0.41) HTR2AHRH1TDP1SMN1; SMN2CYP2C19

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
US-9159352-B2 Polishing liquid composition for magnetic disk substrate KAO CORPORATION (JP) 2015-10-13 US disclosed
CN-103503068-A Manufacturing method of magnetic disk substrate KAO CORP 2014-01-08 CN disclosed
US-20140001155-A1 MANUFACTURING METHOD OF MAGNETIC DISK SUBSTRATE KAO CORPORATION (JP) 2014-01-02 US disclosed
US-20130309946-A1 METHOD FOR MANUFACTURING MAGNETIC DISC SUBSTRATE KAO CORPORATION (JP) 2013-11-21 US disclosed
CN-103339673-A Method for manufacturing magnetic disc substrate KAO CORP 2013-10-02 CN disclosed
US-20120156968-A1 POLISHING LIQUID COMPOSITION FOR MAGNETIC DISK SUBSTRATE KAO CORPORATION (JP) 2012-06-21 US disclosed