Lithium

Lithium

SCHEMBL2822957

O=Cc1ccc(-c2ccccc2)c(-c2nnn[nH]2)c1.[Li]

nearest known ligand 0.36

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
KCNJ1 P48048 1/20 0.35
IP6K1 Q92551 1/20 0.35
AXL P30530 1/20 0.34
TTK P33981 1/20 0.33
KIF11 P52732 2/20 0.32
BTK Q06187 1/20 0.32
CYP2A6 P11509 1/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
XDH P47989 1/20 0.31
TRIM24 O15164 1/20 0.31
TRIM33 Q9UPN9 1/20 0.31
DCUN1D2 Q6PH85 1/20 0.31

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
SCHEMBL3397443 0.99 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL31006315 0.99 ALDH1A1 (0.37) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL2823570 0.97 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL2822952 0.97 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AKDM4ENPC1
SCHEMBL27787520 0.84 ALDH1A1 (0.32) ALDH1A1DCUN1D2DCUN1D1PELI1
Lithium SCHEMBL1562536 0.84 DRD1 (0.41) ALDH1A1CYP2A6XDHDCUN1D2DCUN1D1
SCHEMBL1561472 0.82 DRD1 (0.42) ALDH1A1KCNJ1CYP2A6XDHDCUN1D2
SCHEMBL1561381 0.81 DRD1 (0.41) ALDH1A1CYP2A6XDHDCUN1D2DCUN1D1
Potassium SCHEMBL1561386 0.81 DRD1 (0.41) ALDH1A1CYP2A6XDHDCUN1D2DCUN1D1
SCHEMBL1561389 0.81 DRD1 (0.41) ALDH1A1CYP2A6XDHDCUN1D2DCUN1D1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728024-B2 Metal salts of 2′-(1H-Tetrazol-5yl)-1.1′-biphenyl-4-carboxaldehyde NOVARTIS AG (CH) 2010-06-01 US claimed
CN-101468972-A Metal salt of 2'-(1H-tetrazol-5-yl)-1,1'-biphenyl-4-carbaldehyde NOVARTIS AG (CH) 2009-07-01 CN claimed
CN-101208313-A Metal salts of 2 '- (1H-tetrazol-5-yl) -1, 1' -biphenyl-4-carbaldehyde NOVARTIS AG (CH) 2008-06-25 CN claimed
CN-101468972-A Metal salt of 2'-(1H-tetrazol-5-yl)-1,1'-biphenyl-4-carbaldehyde NOVARTIS AG (CH) 2009-07-01 CN disclosed
CN-101208313-A Metal salts of 2 '- (1H-tetrazol-5-yl) -1, 1' -biphenyl-4-carbaldehyde NOVARTIS AG (CH) 2008-06-25 CN disclosed