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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02274667

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AHU1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(5-IODOURACIL-1-YL)-D-ABABINO-HEXITOL
A,B1KI60.74
6CTPHOSPHORIC ACID MONO-[5-HYDROXYMETHYL-
2-METHYL-3-THYMINYL-CYCLOPENTYLMETHYL]ESTER GROUP
A,B1DAU0.74
AZZ3'-azido-3'-deoxythymidineA,B,C,D2JJ80.75
AZZ3'-azido-3'-deoxythymidineA3B9L0.75
AZZ3'-azido-3'-deoxythymidineA3B9M0.75
AZZ3'-azido-3'-deoxythymidineA3BCR0.75
T39A,B411D0.7
THMTHYMIDINEA,B1W2G0.74
THMTHYMIDINEA3EXK0.74
THMTHYMIDINEA,B,C,D,E,F,
G,H
1G0R0.74
THMTHYMIDINEA3BCU0.74
THMTHYMIDINEA,B1P720.74
THMTHYMIDINEA,B,C,D,E,F,
G,H
1ZMX0.74
THMTHYMIDINEA,B1P6X0.74
THMTHYMIDINEA,B2QQE0.74
THMTHYMIDINEA,B2QQ00.74
THMTHYMIDINEA,B,C,D,E,F,
G,H
1OT30.74
THMTHYMIDINEA3H5Q0.74
THMTHYMIDINEA,B1E2J0.74
THMTHYMIDINEA,B,C,D1H5R0.74
THMTHYMIDINEA2Z1A0.74
THMTHYMIDINEA,B1TLW0.74
THMTHYMIDINEA2VTK0.74
THMTHYMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R
1RXU0.74
THMTHYMIDINEA,B1KIM0.74
THMTHYMIDINEA,B1P7C0.74
THMTHYMIDINEA,B,C,D2B8T0.74
THMTHYMIDINEA2J9R0.74
ADT3'-DEOXY-3'-ACETAMIDO-THYMIDINEA,B8RSA0.76
T32A,B290D0.74
SCT(SOUTH)-METHANOCARBA-THYMIDINEA,B1OF10.76
XTL[(1S,4R,6R)-6-HYDROXY-4-(THYMIN-
9-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE
A,B2H0N0.73
CKB1-beta-D-glucopyranosyl-5-methylpyrimidine-
2,4(1H,3H)-dione
A3BD70.8
HDP[(1S,6S)-6-HYDROXY-4-(5-METHYL-
2,4-DIOXO-3,4-DIHYDROPYRIMIDIN-
1(2H)-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE
A1U010.73
T3S5'-deoxy-5'-piperidin-1-ylthymidineA3D8Y0.76
ZTH(S)-1'-(2',3'-DIHYDROXYPROPYL)-
THYMINE
A2JJA0.74
T662-AMINOETHYLLYSINE-CARBONYLMETHYLENE-
THYMINE
B1NR80.76
TCP5'-METHYLTHYMIDINEA,B,C,D,I,K1TEZ0.74
TCP5'-METHYLTHYMIDINEA1AC30.74
2BT2'-O-BUTYL-THYMIDINEA,B1WV60.7
2BT2'-O-BUTYL-THYMIDINEA,B1WV50.7
TMC1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX-
2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)-
DIONE
A,B1E2K0.77
TMC1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX-
2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)-
DIONE
A,B1E2L0.77
3MEPHOSPHORIC ACID MONO-[4-[2-(2-DIMETHYLAMINO-
ETHOXY)-ETHOXY]-3-HYDROXY-5- (5-
METHYL-2,4-DIOXO-3,4-DIHYDRO-2H-
PYRIMIDIN-1-YL)-TETRAHYDRO-FURAN-
2-YLMETHYL] ESTER
A,B1NZG0.71
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A1D7Z0.77
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A,B1EC40.77
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
B1EJZ0.77
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A,B,C,D,E,G2BJ60.77
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL
A481D0.77
T41B214D0.7
U2LA1XV60.71
PSTTHYMIDINE-5'-THIOPHOSPHATEA,B1KSP0.7
PSTTHYMIDINE-5'-THIOPHOSPHATEA219D0.7
PSTTHYMIDINE-5'-THIOPHOSPHATEA8PSH0.7
PSTTHYMIDINE-5'-THIOPHOSPHATEA,B1KRP0.7
TXS1-(2,5-dideoxy-5-pyrrolidin-1-yl-
beta-L-erythro-pentofuranosyl)-
5-methylpyrimidine-2,4(1H,3H)-dione
A,B3D8Z0.74
2MU2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATEA,B1PWF0.7
2MU2',5-DIMETHYLURIDINE-5'-MONOPHOSPHATEA1FIR0.7
MMT5'-O-(DIMETHYLAMINO)-THYMIDINEA1CX50.73
5AT5'-AMINO-5'-DEOXYTHYMIDINEA,B1KSE0.74
5AT5'-AMINO-5'-DEOXYTHYMIDINEA,B1C950.74
5AT5'-AMINO-5'-DEOXYTHYMIDINEA,B1ON50.74
P2TA,B1Y8V0.7
XTH1-(2,3-DIDEOXY-6-O-PHOSPHONO-BETA-
D-ERYTHRO-HEXOPYRANOSYL)-5-METHYLPYRIMIDINE-
2,4(1H,3H)-DIONE
A,B2H9S0.74
5MUA,B,C,D1IL20.7
5MUV,Y,Z2WDG0.7
5MUC,D1MJ10.7
5MUA1I9V0.7
5MUA,B,C,D,E,F1TTT0.7
5MUX,Y2DLC0.7
5MUP,R1B230.7
5MUA,B,C,D,E,F1OB50.7
5MUV,Z2J020.7
5MUA,B1F7U0.7
5MUA2Z9Q0.7
5MUB,C,D1ZZN0.7
5MUA2TRA0.7
5MUA,B,R,S1ASZ0.7
5MUA1EHZ0.7
5MUM,N1EQQ0.7
5MUA,B,T1H4Q0.7
5MUA6TNA0.7
5MUV,Y,Z3FIC0.7
5MUV,Y,Z2WDH0.7
5MUV,Z2J000.7
5MUT1SER0.7
5MUB,C,D1JGP0.7
5MUC,D3BT70.7
5MUA4TNA0.7
5MUW,Z2V460.7
5MUC,D1EFW0.7
5MUW,Z2V480.7
5MUB,D1U6B0.7
5MUA1EVV0.7
5MU0,Y,Z2OW80.7
5MUA,B,T1H4S0.7
5MUA,B3DEG0.7
5MUA3CW60.7
5MUA1TRA0.7
5MUA3CW50.7
5MUV,Z3FIH0.7
5MUB1F7V0.7
5MUA3TRA0.7
5MUZ3BBV0.7
5MUB,C,D1JGQ0.7
5MUB1ML50.7
5MUA,B,C,D,E1FCW0.7
5MUR,S1ASY0.7
5MUA1KOS0.7
5MUB,C,D1GIX0.7
5MUT1GSG0.7
5MUA,B1QF60.7
5MUA,B1H3E0.7
5MUM2OM70.7
5MUA,B1C0A0.7
5MUO1EG00.7
5MUB,C,D1JGO0.7
5MUB1C2W0.7
5MUB,D,F,H2CZJ0.7
5MUC,D2FMT0.7
5MUA4TRA0.7
5MUA1TN20.7
5MUE,F1SZ10.7
5MUA,C,E,F486D0.7
CJB1-beta-D-glucopyranosylpyrimidine-
2,4(1H,3H)-dione
A3BCS0.7
T48A,B291D0.77