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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03090136

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRK0.74
LA2N~6~-[(6R)-6,8-disulfanyloctanoyl]-
L-lysine
A,B,C,D3CRL0.74
SHMHOMOBIOTINA,B1LDQ0.91
SHMHOMOBIOTINA,B1LCW0.91
BH7E-AMINO BIOTINYL CAPROIC ACIDA,B1LCZ0.96
BH7E-AMINO BIOTINYL CAPROIC ACIDA,B1LEL0.96
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.71
GTXS-HEXYLGLUTATHIONEA,B1AGS0.71
GTXS-HEXYLGLUTATHIONEA,B1PN90.71
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.71
GTXS-HEXYLGLUTATHIONEA,B2IMK0.71
GTXS-HEXYLGLUTATHIONEA,B4GSS0.71
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.71
GTXS-HEXYLGLUTATHIONEA,B2GLR0.71
GTXS-HEXYLGLUTATHIONEA,B2OA70.71
GTXS-HEXYLGLUTATHIONEA,C2AAW0.71
GTXS-HEXYLGLUTATHIONEA,B1VF20.71
GTXS-HEXYLGLUTATHIONEA1M9A0.71
GTXS-HEXYLGLUTATHIONEA,B17GS0.71
GTXS-HEXYLGLUTATHIONEA,B1K0A0.71
GTXS-HEXYLGLUTATHIONEA,B2R3X0.71
GTXS-HEXYLGLUTATHIONEA,B1GSU0.71
GTXS-HEXYLGLUTATHIONEA,B2C800.71
GTXS-HEXYLGLUTATHIONEA,B2R6K0.71
GTXS-HEXYLGLUTATHIONEA,B1PGT0.71
GTXS-HEXYLGLUTATHIONEA,B2J9H0.71
GTXS-HEXYLGLUTATHIONEA,B1K3L0.71
GTXS-HEXYLGLUTATHIONEA,B1GNW0.71
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.71
GTXS-HEXYLGLUTATHIONEA,B1YDK0.71
GTXS-HEXYLGLUTATHIONEA,B9GSS0.71
IP1ISOPENICILLIN NA1QJE0.7
BSOBIOTIN-D-SULFOXIDEA,B2C1S0.89
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3BG50.76
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3HO80.76
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3HB90.76
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3BG30.76
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A1Z6H0.76
BTI5-(HEXAHYDRO-2-OXO-1H-THIENO[3,4-
D]IMIDAZOL-6-YL)PENTANAL
A,B,C,D3HBL0.76
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.73
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.7
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.7
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.7
BTNBIOTINA2IZJ0.91
BTNBIOTINA2EJ90.91
BTNBIOTINA,B2EJG0.91
BTNBIOTINA,B2GH70.91
BTNBIOTINA,B,C,D1SWK0.91
BTNBIOTINA,B,Y,Z3D9L0.91
BTNBIOTINX,Y1Y550.91
BTNBIOTINA,B,C,D2JGS0.91
BTNBIOTINA,B1F270.91
BTNBIOTINA,B,C,D,E,F,
G,H
1WBI0.91
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
1VQN0.91
BTNBIOTINA,B1HXD0.91
BTNBIOTINB,D2RTF0.91
BTNBIOTINA,B2ZSC0.91
BTNBIOTINA1BDO0.91
BTNBIOTINA,B2FYK0.91
BTNBIOTINA,B,C,D1SWG0.91
BTNBIOTINA,B2ZGW0.91
BTNBIOTINA,B,C,D1N430.91
BTNBIOTINB,D2RTG0.91
BTNBIOTINA,B1DF80.91
BTNBIOTINA,B3G8C0.91
BTNBIOTINA,B1WPY0.91
BTNBIOTINA,D2UYW0.91
BTNBIOTINA,B,C,D1SWE0.91
BTNBIOTINB,D2RTD0.91
BTNBIOTIN0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.91
BTNBIOTINA,B1LUQ0.91
BTNBIOTINA,B2AVI0.91
BTNBIOTINA,B1AVD0.91
BTNBIOTINA,B1MK50.91
BTNBIOTINA,B2DTH0.91
BTNBIOTINA,B,C,D,E,F,G3EW20.91
BTNBIOTINB,D2IZG0.91
BTNBIOTINA,D1SWD0.91
BTNBIOTIN0,1,3,4,5,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
1VQ60.91
BTNBIOTINA2C1Q0.91
BTNBIOTINA2C4I0.91
BTNBIOTINA2IZI0.91
BTNBIOTINB,D2RTE0.91
BTNBIOTINA,B2DTO0.91
BTNBIOTINA,B1XNY0.91
BTNBIOTINA,B2DXT0.91
BTNBIOTINA,B2F010.91
BTNBIOTINA,B,C,D1NQM0.91
BTNBIOTINX,Y1Y520.91
BTNBIOTINA1BIB0.91
BTNBIOTINA,B,C,D1SWP0.91
BTNBIOTINB,D2IZF0.91
BTNBIOTINA,B,C,D1SWR0.91
BTNBIOTINA2BDO0.91
BTNBIOTINB,D2IZH0.91
BTNBIOTINA,B,C,D1N9M0.91
BTNBIOTINA,B,C,D1NDJ0.91
BTNBIOTINA,D2UZ20.91
BTNBIOTINA2B8G0.91
BTNBIOTINA1STP0.91
BTNBIOTINA,C,D1SWN0.91
BTNBIOTINA,B,C2EJF0.91
BTNBIOTINA,B1SWT0.91
BTNBIOTINA,B,C,D1MEP0.91
HJ3(2R,4S)-2-[(1R)-1-{[(6S)-6-amino-
6-carboxyhexanoyl]amino}-2-oxoethyl]-
5,5-dimethyl-1,3-thiazolidine-4-
carboxylic acid
A3BEB0.75
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.73
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
A1PWG0.72
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
A1PW10.72
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.73
SNRNORBIOTINA,B1LCV0.9
SNRNORBIOTINA,B1LDO0.9
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.71
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.71
BTQEPI-BIOTINA,B,C,D1SWP0.91
BTQEPI-BIOTINA,B,C,D1SWK0.91
BTQEPI-BIOTINA,B2F010.91
BTQEPI-BIOTINA,B2GH70.91
IMI2-IMINOBIOTINB,D2RTO0.82
IMI2-IMINOBIOTINB,D2IZL0.82
IMI2-IMINOBIOTINB,D2RTQ0.82
IMI2-IMINOBIOTINB,D2RTR0.82
IMI2-IMINOBIOTINA2RTM0.82
IMI2-IMINOBIOTINB,D2RTN0.82
IMI2-IMINOBIOTINB,D2RTP0.82
IMI2-IMINOBIOTINA1NC90.82
IMI2-IMINOBIOTINA2RTL0.82
DTB6-(5-METHYL-2-OXO-IMIDAZOLIDIN-
4-YL)-HEXANOIC ACID
A,B1R300.74
DTB6-(5-METHYL-2-OXO-IMIDAZOLIDIN-
4-YL)-HEXANOIC ACID
A1DAM0.74
DTB6-(5-METHYL-2-OXO-IMIDAZOLIDIN-
4-YL)-HEXANOIC ACID
A,B,C,D3FPA0.74