Proflavine

Proflavine

SCHEMBL28321972

Br.Nc1ccc2cc3ccc(N)cc3nc2c1.c1ccc2nc3ccccc3cc2c1.c1ccc2nc3ccccc3cc2c1

nearest known ligand 0.96

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Proflavine. 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
HTR3A known ✓ P46098 1/20 0.96
ACHE known ✓ P22303 2/20 0.75
CHRM2 known ✓ P08172 1/20 0.75
HTR1A known ✓ P08908 1/20 0.75
ADRA2A known ✓ P08913 1/20 0.75
SLC6A2 known ✓ P23975 1/20 0.75
SLC6A4 known ✓ P31645 1/20 0.75
SLC6A3 known ✓ Q01959 1/20 0.75
KMT2A Q03164 6/20 0.75
MEN1 O00255 4/20 0.75
LMNA P02545 3/20 0.75
HTT P42858 2/20 0.75
F2 P00734 1/20 0.75
ADORA3 P0DMS8 1/20 0.75
MAOA P21397 1/20 0.75
DRD1 P21728 1/20 0.75
PTGS1 P23219 1/20 0.75
OPRM1 P35372 1/20 0.75
DRD3 P35462 1/20 0.75
KDR P35968 1/20 0.75

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
SCHEMBL1229699 0.98 HTR3A (1.00) HTR3AKMT2AMEN1LMNAACHE
Proflavine SCHEMBL3864747 0.98 HTR3A (1.00) HTR3AKMT2AMEN1LMNAACHE
Hydrochloric Acid SCHEMBL28534457 0.94 HTR3A (0.92) HTR3AKMT2AMEN1LMNAACHE
Alcohol SCHEMBL29120969 0.87 HTR3A (0.79) HTR3AKMT2AMEN1LMNAACHE
Proflavine SCHEMBL27386 0.87 KMT2A (1.00) HTR3AKMT2AMEN1LMNAACHE
Proflavine SCHEMBL29600097 0.87 KMT2A (1.00) HTR3AKMT2AMEN1LMNAACHE
Sulfuric Acid SCHEMBL28530710 0.86 HTR3A (0.77) HTR3AKMT2AMEN1LMNAACHE
SCHEMBL30076611 0.85 HTR3A (0.77) HTR3AKMT2AMEN1LMNAACHE
SCHEMBL1230201 0.85 HTR3A (0.77) HTR3AKMT2AMEN1LMNAACHE
Proflavine SCHEMBL11072089 0.84 KMT2A (0.77) HTR3AKMT2AMEN1LMNAACHE

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
CN-110177621-A METHODS AND SYSTEMS FOR NUCLEIC ACID ANALYSIS AND QUANTIFICATION 康比纳提公司 2019-08-27 CN disclosed