Bromide

Bromide

SCHEMBL11330583

Cc1sc2ccc(Cl)cc2[n+]1CCC=O.[Br-]

nearest known ligand 0.47

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 11/20 0.47
KDM4E B2RXH2 2/20 0.45
THRB P10828 2/20 0.43
RECQL P46063 2/20 0.43
CYP2D6 P10635 2/20 0.39
HSD17B10 Q99714 2/20 0.39
TSHR P16473 1/20 0.39
HPGD P15428 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
GAA P10253 1/20 0.38
CYP2C9 P11712 1/20 0.38
INSR P06213 1/20 0.34
LMNA P02545 1/20 0.33
APOBEC3A P31941 1/20 0.33
POLB P06746 1/20 0.31
ROCK1 Q13464 1/20 0.31
SMN1; SMN2 Q16637 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 SCHEMBL3288546 0.82 MAPT (0.68) MAPTKDM4ETHRBRECQLCYP2D6
Bromide SCHEMBL7762935 0.80 CYP2D6 (0.60) MAPTKDM4ETHRBRECQLCYP2D6
Bromide SCHEMBL3284767 0.79 MAPT (0.53) MAPTKDM4ETHRBRECQLCYP2D6
SCHEMBL13646785 0.78 CYP2D6 (0.66) MAPTKDM4ETHRBRECQLCYP2D6
SCHEMBL1048707 0.77 MAPT (0.54) MAPTKDM4ETHRBRECQLCYP2D6
Iodide SCHEMBL11883305 0.77 CYP2D6 (0.60) MAPTKDM4ETHRBRECQLCYP2D6
Iodide SCHEMBL4012476 0.76 MAPT (0.57) MAPTKDM4ETHRBRECQLCYP2D6
SCHEMBL12201210 0.75 KDM4E (0.51) MAPTKDM4ETHRBRECQLCYP2D6
SCHEMBL8517706 0.75 MAPT (0.77) MAPTKDM4ETHRBRECQLCYP2D6
SCHEMBL9226505 0.75 MAPT (0.62) MAPTKDM4ETHRBRECQLCYP2D6

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
US-4279987-A 2,5-DIHYDROXY-BIPHENYL COMPOUNDS ADDED AS DEVELOPMENT ACCELERATORS KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-07-21 US disclosed
US-4268621-A Direct positive photographic material KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1981-05-19 US disclosed
US-4150993-A AMINEBORANE COMPOUND KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1979-04-24 US disclosed