Dipyridyl

Dipyridyl

SCHEMBL8102799

Cc1ccnc(-c2cc(CN)ccn2)c1.[O-][Cl+3]([O-])([O-])O.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1

nearest known ligand 0.45

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.45
CCR5 P51681 2/20 0.45
CCR8 P51685 2/20 0.45
LOXL2 Q9Y4K0 10/20 0.43
LOX P28300 3/20 0.43
KARS1 Q15046 1/20 0.41
KDM4E B2RXH2 2/20 0.38
KDM6B O15054 1/20 0.38
KDM4A O75164 1/20 0.38
KDM5C P41229 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
KDM3A Q9Y4C1 1/20 0.38
KCNN1 Q92952 1/20 0.38
KCNN2 Q9H2S1 1/20 0.38
KCNN3 Q9UGI6 1/20 0.38
HPGD P15428 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SLC2A1 P11166 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.37

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
Perchlorate SCHEMBL9339609 0.92 CCR1 (0.53) CCR1CCR5CCR8LOXL2LOX
SCHEMBL7036361 0.83 LOXL2 (0.56) CCR1CCR5CCR8LOXL2LOX
SCHEMBL30485802 0.83 LOXL2 (0.56) CCR1CCR5CCR8LOXL2LOX
SCHEMBL29978828 0.83 CCR1 (0.65) CCR1CCR5CCR8LOXL2LOX
Dipyridyl SCHEMBL28342586 0.78 CCR1 (0.74) CCR1CCR5CCR8KDM4EKDM6B
SCHEMBL563123 0.78 CCR1 (0.74) CCR1CCR5CCR8KDM4EKDM6B
Dipyridyl SCHEMBL1923113 0.77 CCR1 (0.46) CCR1CCR5CCR8KARS1KDM4E
Dipyridyl SCHEMBL8658875 0.77 CCR1 (0.46) CCR1CCR5CCR8KDM4EKDM6B
Dipyridyl SCHEMBL1318097 0.77 CCR1 (0.46) CCR1CCR5CCR8KARS1KDM4E
Dipyridyl SCHEMBL5004969 0.76 CCR1 (0.45) CCR1CCR5CCR8KARS1KDM4E

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-6132648-A ELECTRODES AND IMMOBILIZED LAYER BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2000-10-17 US disclosed