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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03200912

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ATDTHYMIDINE-3'-PHOSPHATEA,B1BX50.7
AZZ3'-azido-3'-deoxythymidineA,B,C,D2JJ80.73
AZZ3'-azido-3'-deoxythymidineA3B9L0.73
AZZ3'-azido-3'-deoxythymidineA3B9M0.73
AZZ3'-azido-3'-deoxythymidineA3BCR0.73
6CTPHOSPHORIC ACID MONO-[5-HYDROXYMETHYL-
2-METHYL-3-THYMINYL-CYCLOPENTYLMETHYL]ESTER GROUP		A,B1DAU0.84
THMTHYMIDINEA,B1W2G0.75
THMTHYMIDINEA3EXK0.75
THMTHYMIDINEA,B,C,D,E,F,
G,H		1G0R0.75
THMTHYMIDINEA3BCU0.75
THMTHYMIDINEA,B1P720.75
THMTHYMIDINEA,B,C,D,E,F,
G,H		1ZMX0.75
THMTHYMIDINEA,B1P6X0.75
THMTHYMIDINEA,B2QQE0.75
THMTHYMIDINEA,B2QQ00.75
THMTHYMIDINEA,B,C,D,E,F,
G,H		1OT30.75
THMTHYMIDINEA3H5Q0.75
THMTHYMIDINEA,B1E2J0.75
THMTHYMIDINEA,B,C,D1H5R0.75
THMTHYMIDINEA2Z1A0.75
THMTHYMIDINEA,B1TLW0.75
THMTHYMIDINEA2VTK0.75
THMTHYMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R		1RXU0.75
THMTHYMIDINEA,B1KIM0.75
THMTHYMIDINEA,B1P7C0.75
THMTHYMIDINEA,B,C,D2B8T0.75
THMTHYMIDINEA2J9R0.75
DUR2'-DEOXYURIDINEA,B,F1OE50.71
DUR2'-DEOXYURIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R		1RXS0.71
DUR2'-DEOXYURIDINEA1BDU0.71
DUR2'-DEOXYURIDINEA,B1TDU0.71
DUR2'-DEOXYURIDINEA,B2I7D0.71
DUR2'-DEOXYURIDINEA2C530.71
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A1D7Z0.71
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A,B1EC40.71
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		B1EJZ0.71
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A,B,C,D,E,G2BJ60.71
6HT1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(THYMIN-1-YL)-6'-O-PHOSPHORYL-D-
ARABINO-HEXITOL		A481D0.71
T48A,B291D0.83
DRTA1FV80.7
T32A,B290D0.84
AHU1',5'-ANHYDRO-2',3'-DIDEOXY-2'-
(5-IODOURACIL-1-YL)-D-ABABINO-HEXITOL		A,B1KI60.73
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		A1U010.74
TMC1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX-
2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)-
DIONE		A,B1E2K0.83
TMC1-[4-HYDROXY-5-(HYDROXYMETHYL)BICYCLO[3.1.0]HEX-
2-YL]-5-METHYLPYRIMIDINE-2,4(1H,3H)-
DIONE		A,B1E2L0.83
SCT(SOUTH)-METHANOCARBA-THYMIDINEA,B1OF10.83
XTL[(1S,4R,6R)-6-HYDROXY-4-(THYMIN-
9-YL)CYCLOHEX-2-EN-1-YL]METHYL DIHYDROGEN PHOSPHATE		A,B2H0N0.74
5UD5-FLUOROURIDINEA,B1TGV0.7
5UD5-FLUOROURIDINEA,B,C,D,E,F,
I,J,K,L		1RXC0.7
U33A,B,C,D,E,F,
G,H		2GRB0.7
TCP5'-METHYLTHYMIDINEA,B,C,D,I,K1TEZ0.74
TCP5'-METHYLTHYMIDINEA1AC30.74
CKB1-beta-D-glucopyranosyl-5-methylpyrimidine-
2,4(1H,3H)-dione		A3BD70.72
PSTTHYMIDINE-5'-THIOPHOSPHATEA,B1KSP0.72
PSTTHYMIDINE-5'-THIOPHOSPHATEA219D0.72
PSTTHYMIDINE-5'-THIOPHOSPHATEA8PSH0.72
PSTTHYMIDINE-5'-THIOPHOSPHATEA,B1KRP0.72
5AT5'-AMINO-5'-DEOXYTHYMIDINEA,B1KSE0.72
5AT5'-AMINO-5'-DEOXYTHYMIDINEA,B1C950.72
5AT5'-AMINO-5'-DEOXYTHYMIDINEA,B1ON50.72
ADT3'-DEOXY-3'-ACETAMIDO-THYMIDINEA,B8RSA0.7
T2STHYMIDINE-5'-DITHIOPHOSPHORATEA,B1K8L0.71
ID25-IODODEOXYURIDINEA,B1KI70.71
TXS1-(2,5-dideoxy-5-pyrrolidin-1-yl-
beta-L-erythro-pentofuranosyl)-
5-methylpyrimidine-2,4(1H,3H)-dione		A,B3D8Z0.7
MMT5'-O-(DIMETHYLAMINO)-THYMIDINEA1CX50.73
TMPTHYMIDINE-5'-PHOSPHATEA,B1OI60.7
TMPTHYMIDINE-5'-PHOSPHATEA1E2G0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B2CCG0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B2Q7T0.7
TMPTHYMIDINE-5'-PHOSPHATEX1MW80.7
TMPTHYMIDINE-5'-PHOSPHATEA1CY40.7
TMPTHYMIDINE-5'-PHOSPHATEA1E2F0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B,C,D2O4G0.7
TMPTHYMIDINE-5'-PHOSPHATEA2QXF0.7
TMPTHYMIDINE-5'-PHOSPHATEA1E9C0.7
TMPTHYMIDINE-5'-PHOSPHATEA1E2Q0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B1TMK0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B2CCJ0.7
TMPTHYMIDINE-5'-PHOSPHATEA3BGX0.7
TMPTHYMIDINE-5'-PHOSPHATEA1TYS0.7
TMPTHYMIDINE-5'-PHOSPHATEA1VTK0.7
TMPTHYMIDINE-5'-PHOSPHATEA1CY80.7
TMPTHYMIDINE-5'-PHOSPHATEA1E2E0.7
TMPTHYMIDINE-5'-PHOSPHATEA1GSI0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B2QQ00.7
TMPTHYMIDINE-5'-PHOSPHATEA1E9E0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B1N5K0.7
TMPTHYMIDINE-5'-PHOSPHATEA1Z4L0.7
TMPTHYMIDINE-5'-PHOSPHATEA2Q7U0.7
TMPTHYMIDINE-5'-PHOSPHATEA1CY20.7
TMPTHYMIDINE-5'-PHOSPHATEA,B2RDJ0.7
TMPTHYMIDINE-5'-PHOSPHATEA1CY10.7
TMPTHYMIDINE-5'-PHOSPHATEA1J540.7
TMPTHYMIDINE-5'-PHOSPHATEA,B1N5L0.7
TMPTHYMIDINE-5'-PHOSPHATEA1E9F0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B1QZG0.7
TMPTHYMIDINE-5'-PHOSPHATEA1N5I0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B2PAR0.7
TMPTHYMIDINE-5'-PHOSPHATEA1E2D0.7
TMPTHYMIDINE-5'-PHOSPHATEA1G3U0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B,C,D3B6P0.7
TMPTHYMIDINE-5'-PHOSPHATEA1LCB0.7
TMPTHYMIDINE-5'-PHOSPHATEX2FTO0.7
TMPTHYMIDINE-5'-PHOSPHATEA1CY70.7
TMPTHYMIDINE-5'-PHOSPHATEA,B,C,D3B6O0.7
TMPTHYMIDINE-5'-PHOSPHATEA,C2IDO0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B,C,D,E,F,
G,H		1FXO0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B1GTV0.7
TMPTHYMIDINE-5'-PHOSPHATEA,B,C,D1H5S0.7
TMPTHYMIDINE-5'-PHOSPHATEA1J530.7
T3PTHYMIDINE-3'-PHOSPHATEA1Z4K0.7
T3PTHYMIDINE-3'-PHOSPHATEA1CY80.7
T3PTHYMIDINE-3'-PHOSPHATEA1C2Q0.7
T3PTHYMIDINE-3'-PHOSPHATEA1CY60.7
T3S5'-deoxy-5'-piperidin-1-ylthymidineA3D8Y0.7