Bromide

Bromide

SCHEMBL7842108

Br.O=C(O)c1ccnc(Cl)c1

nearest known ligand 0.59

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
KDM4C Q9H3R0 6/20 0.59
KDM5C P41229 5/20 0.59
KDM4E B2RXH2 4/20 0.59
KDM2A Q9Y2K7 4/20 0.59
KDM3A Q9Y4C1 4/20 0.59
KDM4A O75164 4/20 0.59
KDM6B O15054 3/20 0.59
KDM5B Q9UGL1 3/20 0.59
KDM5A P29375 2/20 0.59
KDM4D Q6B0I6 2/20 0.59
TET3 O43151 1/20 0.59
BBOX1 O75936 1/20 0.59
ALDH1A1 P00352 1/20 0.59
MAPT P10636 1/20 0.59
ASPH Q12797 1/20 0.59
TET2 Q6N021 1/20 0.59
ALKBH5 Q6P6C2 1/20 0.59
KDM7A Q6ZMT4 1/20 0.59
KDM8 Q8N371 1/20 0.59
TET1 Q8NFU7 1/20 0.59

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
SCHEMBL40123 0.98 KDM4C (0.61) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL31547893 0.96 KDM4C (0.59) KDM4CKDM5CKDM4EKDM2AKDM3A
Hydrochloric Acid SCHEMBL7221156 0.96 KDM4C (0.59) KDM4CKDM5CKDM4EKDM2AKDM3A
Methane SCHEMBL9122275 0.96 KDM5C (0.59) KDM4CKDM5CKDM4EKDM2AKDM3A
Hydrogen Sulfide SCHEMBL27953098 0.90 KDM5C (0.53) KDM4CKDM5CKDM4EKDM2AKDM3A
Isonicotinic Acid SCHEMBL28210508 0.90 NAPRT (0.63) KDM4CKDM5CKDM4EKDM2AKDM3A
Alcohol SCHEMBL28687926 0.89 KDM5B (0.52) KDM4CKDM5CKDM4EKDM2AKDM3A
Tert-Butanol SCHEMBL27878420 0.89 KDM4C (0.52) KDM4CKDM5CKDM4EKDM2AKDM3A
SCHEMBL27623752 0.83 RECQL (0.47) KDM4CKDM5CKDM4EKDM2AKDM3A
Bromide SCHEMBL3611932 0.82 SMARCA2 (0.47) KDM4CKDM5CKDM4EKDM2AKDM3A

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
EP-0763530-B1 Chloropyridylcarbonyl derivatives and their use as microbiocides BAYER AGROCHEM KK (JP) 2001-12-05 EP disclosed
US-5849767-A Chloropyridylcarbonyl derivatives NIHON BAYER AGROCHEM K.K. (JP) 1998-12-15 US disclosed
EP-0763530-A1 Chloropyridylcarbonyl derivatives and their use as microbiocides NIHON BAYER AGROCHEM K.K. (JP) 1997-03-19 EP disclosed