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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00333226

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BSOBIOTIN-D-SULFOXIDEA,B2C1S0.77
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.7
DAA8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDEA1BS10.76
SNRNORBIOTINA,B1LCV0.77
SNRNORBIOTINA,B1LDO0.77
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.71
BTQEPI-BIOTINA,B,C,D1SWP0.79
BTQEPI-BIOTINA,B,C,D1SWK0.79
BTQEPI-BIOTINA,B2F010.79
BTQEPI-BIOTINA,B2GH70.79
DPUMIXED CARBAMIC PHOSPHORIC ACID ANHYDRIDE OF 7,8-
DIAMINONONANIC ACID
A1DAK0.73
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.7
SHMHOMOBIOTINA,B1LDQ0.79
SHMHOMOBIOTINA,B1LCW0.79
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAG0.78
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAF0.78
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA,B,C,D3FMF0.78
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAI0.78
PCJ(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-
1,2-DIYL DIHEXADECANOATE
A,N2Z810.74
PCJ(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-
1,2-DIYL DIHEXADECANOATE
A,B,C2Z7X0.74
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.73
IMI2-IMINOBIOTINB,D2RTO0.71
IMI2-IMINOBIOTINB,D2IZL0.71
IMI2-IMINOBIOTINB,D2RTQ0.71
IMI2-IMINOBIOTINB,D2RTR0.71
IMI2-IMINOBIOTINA2RTM0.71
IMI2-IMINOBIOTINB,D2RTN0.71
IMI2-IMINOBIOTINB,D2RTP0.71
IMI2-IMINOBIOTINA1NC90.71
IMI2-IMINOBIOTINA2RTL0.71
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3BG50.7
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3HO80.7
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3HB90.7
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3BG30.7
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A1Z6H0.7
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3HBL0.7
DTB6-(5-METHYL-2-OXO-IMIDAZOLIDIN-
4-YL)-HEXANOIC ACID
A,B1R300.73
DTB6-(5-METHYL-2-OXO-IMIDAZOLIDIN-
4-YL)-HEXANOIC ACID
A1DAM0.73
DTB6-(5-METHYL-2-OXO-IMIDAZOLIDIN-
4-YL)-HEXANOIC ACID
A,B,C,D3FPA0.73
HEL(2S,5R,6R)-6-{[(6R)-6-(GLYCYLAMINO)-
7-OXIDO-7-OXOHEPTANOYL]AMINO}-3,3-
DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLATE
A1PWG0.74
HEL(2S,5R,6R)-6-{[(6R)-6-(GLYCYLAMINO)-
7-OXIDO-7-OXOHEPTANOYL]AMINO}-3,3-
DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLATE
A1PW10.74
BTNBIOTINA2IZJ0.79
BTNBIOTINA2EJ90.79
BTNBIOTINA,B2EJG0.79
BTNBIOTINA,B2GH70.79
BTNBIOTINA,B,C,D1SWK0.79
BTNBIOTINA,B,Y,Z3D9L0.79
BTNBIOTINX,Y1Y550.79
BTNBIOTINA,B,C,D2JGS0.79
BTNBIOTINA,B1F270.79
BTNBIOTINA,B,C,D,E,F,
G,H
1WBI0.79
BTNBIOTIN0,1,2,3,4,5,
9,A,B,C,D,F,
H,J,K,L,M,N,
O,Q,R,S,T,U,
Y,Z
1VQN0.79
BTNBIOTINA,B1HXD0.79
BTNBIOTINB,D2RTF0.79
BTNBIOTINA,B2ZSC0.79
BTNBIOTINA1BDO0.79
BTNBIOTINA,B2FYK0.79
BTNBIOTINA,B,C,D1SWG0.79
BTNBIOTINA,B2ZGW0.79
BTNBIOTINA,B,C,D1N430.79
BTNBIOTINB,D2RTG0.79
BTNBIOTINA,B1DF80.79
BTNBIOTINA,B3G8C0.79
BTNBIOTINA,B1WPY0.79
BTNBIOTINA,D2UYW0.79
BTNBIOTINA,B,C,D1SWE0.79
BTNBIOTINB,D2RTD0.79
BTNBIOTIN0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.79
BTNBIOTINA,B1LUQ0.79
BTNBIOTINA,B2AVI0.79
BTNBIOTINA,B1AVD0.79
BTNBIOTINA,B1MK50.79
BTNBIOTINA,B2DTH0.79
BTNBIOTINA,B,C,D,E,F,G3EW20.79
BTNBIOTINB,D2IZG0.79
BTNBIOTINA,D1SWD0.79
BTNBIOTIN0,1,3,4,5,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
1VQ60.79
BTNBIOTINA2C1Q0.79
BTNBIOTINA2C4I0.79
BTNBIOTINA2IZI0.79
BTNBIOTINB,D2RTE0.79
BTNBIOTINA,B2DTO0.79
BTNBIOTINA,B1XNY0.79
BTNBIOTINA,B2DXT0.79
BTNBIOTINA,B2F010.79
BTNBIOTINA,B,C,D1NQM0.79
BTNBIOTINX,Y1Y520.79
BTNBIOTINA1BIB0.79
BTNBIOTINA,B,C,D1SWP0.79
BTNBIOTINB,D2IZF0.79
BTNBIOTINA,B,C,D1SWR0.79
BTNBIOTINA2BDO0.79
BTNBIOTINB,D2IZH0.79
BTNBIOTINA,B,C,D1N9M0.79
BTNBIOTINA,B,C,D1NDJ0.79
BTNBIOTINA,D2UZ20.79
BTNBIOTINA2B8G0.79
BTNBIOTINA1STP0.79
BTNBIOTINA,C,D1SWN0.79
BTNBIOTINA,B,C2EJF0.79
BTNBIOTINA,B1SWT0.79
BTNBIOTINA,B,C,D1MEP0.79
BH7E-AMINO BIOTINYL CAPROIC ACIDA,B1LCZ0.76
BH7E-AMINO BIOTINYL CAPROIC ACIDA,B1LEL0.76
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRK0.71
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRL0.71
HJ3(2R,4S)-2-[(1R)-1-{[(6S)-6-amino-
6-carboxyhexanoyl]amino}-2-oxoethyl]-
5,5-dimethyl-1,3-thiazolidine-4-
carboxylic acid
A3BEB0.77