Bromide

Bromide

SCHEMBL4128855

CC(=C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)NC(C)(C)C.[Br-]

nearest known ligand 0.38

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
EGFR P00533 1/20 0.38
CYP2C9 P11712 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MAPT P10636 5/20 0.34
GAA P10253 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
CYP2C19 P33261 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
EPHX1 P07099 1/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 2/20 0.33
ALPL P05186 1/20 0.33
ALPI P09923 1/20 0.33

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 SCHEMBL4128852 1.00 EGFR (0.38) EGFRCYP2C9SMN1; SMN2MAPTGAA
Bromide SCHEMBL4134863 0.76 MAPT (0.49) SMN1; SMN2MAPTGAAMEN1KMT2A
Bromide SCHEMBL4134861 0.76 MAPT (0.49) SMN1; SMN2MAPTGAAMEN1KMT2A
Bromide SCHEMBL18523399 0.74 TRPA1 (0.35) SMN1; SMN2MAPTMEN1KMT2AALDH1A1
Bromide SCHEMBL4139679 0.72 KMT2A (0.49) SMN1; SMN2MEN1KMT2ALMNA
Bromide SCHEMBL4139683 0.72 KMT2A (0.49) SMN1; SMN2MEN1KMT2ALMNA
Bromide SCHEMBL4137969 0.71 POLB (0.41) CYP2C9GAAMEN1KMT2AALDH1A1
Bromide SCHEMBL4137968 0.71 POLB (0.41) CYP2C9GAAMEN1KMT2AALDH1A1
SCHEMBL11119867 0.69 EGFR (0.50) EGFRCYP2C9SMN1; SMN2MAPTGAA
SCHEMBL20857410 0.69 TRPA1 (0.34) ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163740-A1 LIGANDS FOR METALS AS CATALYSTS FOR CARBON-CARBON BOND FORMATION NATIONAL SUN YAT-SEN UNIVERSITY 2009-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090163740-A1 LIGANDS FOR METALS AS CATALYSTS FOR CARBON-CARBON BOND FORMATION NCOR2, OXGR1, NCOR1 EGFR 1135/4885CYP2C9 471/4885SMN1; SMN2 3781/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.