Bromide

Bromide

SCHEMBL6056708

Br.NC(=O)c1cc2ccccc2[nH]1

nearest known ligand 0.69

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
▸ FLT3 P36888 4/20 0.69
▸ KDM4E B2RXH2 4/20 0.67
▸ HSD17B10 Q99714 2/20 0.67
▸ MAPT P10636 1/20 0.67
▸ DAO P14920 1/20 0.67
▸ HPGD P15428 1/20 0.67
▸ SRD5A2 P31213 1/20 0.67
▸ ALDH1A1 P00352 1/20 0.64
▸ GAA P10253 1/20 0.64
▸ MAPK1 P28482 1/20 0.64
▸ LMNA P02545 2/20 0.56
▸ PDGFRB P09619 2/20 0.56
▸ PDGFRA P16234 2/20 0.56
▸ SMN1; SMN2 Q16637 2/20 0.56
▸ IDO1 P14902 1/20 0.56
▸ NPC1 O15118 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ TP53 P04637 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ HRH4 Q9H3N8 2/20 0.51

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
SCHEMBL118686 0.98 FLT3 (0.71) FLT3KDM4EHSD17B10MAPTDAO
SCHEMBL29362757 0.98 FLT3 (0.71) FLT3KDM4EHSD17B10MAPTDAO
Hydrochloric Acid SCHEMBL30071329 0.96 FLT3 (0.69) FLT3KDM4EHSD17B10MAPTDAO
Hydrochloric Acid SCHEMBL20569802 0.96 FLT3 (0.69) FLT3KDM4EHSD17B10MAPTDAO
Hydrochloric Acid SCHEMBL28280255 0.96 FLT3 (0.69) FLT3KDM4EHSD17B10MAPTDAO
Hydrochloric Acid SCHEMBL16463892 0.96 FLT3 (0.69) FLT3KDM4EHSD17B10MAPTDAO
Hydrochloric Acid SCHEMBL30164222 0.96 FLT3 (0.69) FLT3KDM4EHSD17B10MAPTDAO
Water SCHEMBL30277651 0.96 FLT3 (0.69) FLT3KDM4EHSD17B10MAPTDAO
Pyrrole SCHEMBL7648947 0.90 KDM4E (0.61) FLT3KDM4EHSD17B10MAPTDAO
Isopropyl Alcohol SCHEMBL11540479 0.90 FLT3 (0.61) FLT3KDM4EHSD17B10MAPTDAO

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
WO-2023077117-A1 CRYSTALLINE FORMS OF N-((1R,3S)-3-(4-ACETYLPIPERAZIN-1-YL)CYCLOHEXYL)-4-FLUORO-7-METHYL-1H-INDOLE-2-CARBOXAMIDE Epizyme, Inc. (US) 2023-05-04 — — WO claimed
WO-2023077117-A1 CRYSTALLINE FORMS OF N-((1R,3S)-3-(4-ACETYLPIPERAZIN-1-YL)CYCLOHEXYL)-4-FLUORO-7-METHYL-1H-INDOLE-2-CARBOXAMIDE Epizyme, Inc. (US) 2023-05-04 — — WO disclosed
EP-1648905-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS Abbott Laboratories (US) 2006-04-26 — — EP disclosed
WO-2005010009-A1 THIENOPYRIDINE AND FUROPYRIDINE KINASE INHIBITORS ABBOTT LABORATORIES (US) 2005-02-03 — — WO disclosed
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