Bromide

Bromide

SCHEMBL8906346

Br.C#CCN1c2ccccc2C=CC1C

nearest known ligand 0.42

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 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
P2RX1 P51575 1/20 0.31
P2RX3 P56373 1/20 0.31
P2RX4 Q99571 1/20 0.31
P2RX7 Q99572 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
CYP2C19 P33261 1/20 0.31
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPT P10636 1/20 0.31
TRPA1 O75762 1/20 0.30

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
SCHEMBL4595897 0.78 KMT2A (0.47) MEN1KMT2ASMN1; SMN2LMNAP2RX1
Iodide SCHEMBL27570286 0.77 KMT2A (0.46) MEN1KMT2ASMN1; SMN2LMNAP2RX1
SCHEMBL31536053 0.74 MEN1 (0.48) MEN1KMT2ASMN1; SMN2LMNAP2RX4
Bromide SCHEMBL2027811 0.70 MEN1 (0.41) MEN1KMT2ASMN1; SMN2LMNAP2RX1
SCHEMBL28742796 0.69 MEN1 (0.43) MEN1KMT2ALMNAP2RX4MAPK1
SCHEMBL27542972 0.69 MEN1 (0.43) MEN1KMT2ALMNAP2RX4MAPK1
SCHEMBL30100361 0.69 MEN1 (0.51) MEN1KMT2ASMN1; SMN2LMNAP2RX1
SCHEMBL20651294 0.69 MEN1 (0.51) MEN1KMT2ASMN1; SMN2LMNAP2RX1
SCHEMBL4595683 0.69 MEN1 (0.51) MEN1KMT2ASMN1; SMN2LMNAP2RX1
Iodide SCHEMBL28149370 0.67 MEN1 (0.50) MEN1KMT2ASMN1; SMN2LMNAP2RX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5691121-A PHOTOGRAPHIC LIGHT-SENSITIVE SILVER HALIDE MATERIAL AGFA-GEVAERT. N.V. (BE) 1997-11-25 US disclosed
EP-0704751-A1 Method for making negative lith images or direct positive images AGFA-GEVAERT N.V. (BE) 1996-04-03 EP disclosed