Bromide

Bromide

SCHEMBL9017450

COc1cc2[nH]c3ccccc3c2cc1[N+]#N.[Br-]

nearest known ligand 0.61

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
KDM4E B2RXH2 3/20 0.61
MAPT P10636 3/20 0.61
ATM Q13315 1/20 0.61
AHR P35869 1/20 0.53
ALDH1A1 P00352 3/20 0.50
HSD17B10 Q99714 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HPGD P15428 1/20 0.50
GABRP O00591 1/20 0.46
GABRD O14764 1/20 0.46
GABRA1 P14867 1/20 0.46
GABRB1 P18505 1/20 0.46
GABRG2 P18507 1/20 0.46
GABRB3 P28472 1/20 0.46
GABRA5 P31644 1/20 0.46
GABRA3 P34903 1/20 0.46
GABRA2 P47869 1/20 0.46
GABRB2 P47870 1/20 0.46
GABRA4 P48169 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
SCHEMBL7983972 0.81 KDM4E (0.77) KDM4EMAPTATMAHRALDH1A1
SCHEMBL15926660 0.78 KDM4E (0.73) KDM4EMAPTATMAHRALDH1A1
SCHEMBL4143973 0.76 MAPT (1.00) KDM4EMAPTATMAHRALDH1A1
SCHEMBL4259365 0.75 KDM4E (0.69) KDM4EMAPTATMAHRALDH1A1
SCHEMBL29380459 0.73 AHR (1.00) KDM4EMAPTATMAHRALDH1A1
SCHEMBL12219476 0.73 AHR (1.00) KDM4EMAPTATMAHRALDH1A1
SCHEMBL12219478 0.73 AHR (1.00) KDM4EMAPTATMAHRALDH1A1
SCHEMBL550602 0.73 AHR (1.00) KDM4EMAPTATMAHRALDH1A1
Glycosinine SCHEMBL30839690 0.72 KDM4E (0.63) KDM4EMAPTATMAHRALDH1A1
Hydrochloric Acid SCHEMBL3792797 0.70 KDM4E (0.47) KDM4EMAPTATMALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5538825-A Printing plate preparation process XEROX CORPORATION (US) 1996-07-23 US claimed
US-5102756-A Camera speed printing plate with in situ mask XEROX CORPORATION (US) 1992-04-07 US claimed
US-5538825-A Printing plate preparation process XEROX CORPORATION (US) 1996-07-23 US disclosed
US-5102756-A Camera speed printing plate with in situ mask XEROX CORPORATION (US) 1992-04-07 US disclosed