Sugi Predict

Sugi Predict / Compounds / Bromide

Bromide

Bromide

SCHEMBL7312935

Br.CC(OC(=O)CN1Cc2cc(OCCCC(=O)N(C)C3CCCCC3)ccc2N=C1N)C(C)(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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 4)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 20/20 1.00
▸ PDE4B Q07343 20/20 1.00
▸ PDE4C Q08493 20/20 1.00
▸ PDE4D Q08499 20/20 1.00

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
SCHEMBL7313376 1.00 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7316852 0.92 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311186 0.90 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7320747 0.88 PDE4A (0.79) PDE4APDE4BPDE4CPDE4D
SCHEMBL7311645 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7307591 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7318809 0.88 PDE4A (0.85) PDE4APDE4BPDE4CPDE4D
SCHEMBL7319578 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D
SCHEMBL7313748 0.88 PDE4A (0.78) PDE4APDE4BPDE4CPDE4D
Bromide SCHEMBL7309492 0.88 PDE4A (1.00) PDE4APDE4BPDE4CPDE4D

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-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 — — US disclosed