Bromide

Bromide

SCHEMBL3863602

Br.Cc1ccc(-c2cn3c(n2)sc2ccc([N+](=O)[O-])cc23)cc1

nearest known ligand 0.50

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
LMNA P02545 6/20 0.50
RAB9A P51151 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
STAT3 P40763 1/20 0.50
CASP3 P42574 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
F2RL3 Q96RI0 1/20 0.45
MBD2 Q9UBB5 1/20 0.45
THRB P10828 2/20 0.43
MAPT P10636 6/20 0.43
HDAC6 Q9UBN7 1/20 0.43
TP53 P04637 3/20 0.42
TSHR P16473 1/20 0.41
ATM Q13315 1/20 0.41

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 SCHEMBL3863593 0.91 LMNA (0.55) LMNARAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL13539252 0.85 LMNA (0.53) LMNARAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL73436 0.83 F2RL3 (0.46) LMNARAB9ASMN1; SMN2NPC1F2RL3
SCHEMBL774164 0.82 TP53 (0.57) LMNARAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL14875121 0.80 F2RL3 (0.46) LMNARAB9ASMN1; SMN2ALDH1A1POLB
Bromide SCHEMBL3865729 0.80 LMNA (0.49) LMNARAB9ASMN1; SMN2NPC1F2RL3
SCHEMBL73916 0.80 MBD2 (0.58) LMNARAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL72902 0.79 AKR1C3 (0.47) LMNARAB9ASMN1; SMN2F2RL3MBD2
SCHEMBL74474 0.78 F2RL3 (0.42) LMNASMN1; SMN2ALDH1A1F2RL3MBD2
SCHEMBL3864619 0.78 LMNA (0.50) LMNARAB9ASMN1; SMN2NPC1THRB

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-7601846-B2 Compounds having activity as inhibitors of apoptosis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-10-13 US disclosed
US-20060122178-A1 Compounds having activity as inhibitors of apoptosis REGENTS OF THE UNIVERSITY OF CALIFORNIA, THE 2006-06-08 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-20060122178-A1 Compounds having activity as inhibitors of apoptosis BAD, CASP3, BAX LMNA 1024/4885RAB9A 3287/4885SMN1; SMN2 3506/4885

“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.