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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02425887

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHZ3,4-DIHYDRO-1H-PYRIMIDIN-2-ONE NUCLEOSIDEA1CTT0.79
TA3(4S,5R)-3-(2-DEOXY-5-O-PHOSPHONO-
BETA-D-ERYTHRO-PENTOFURANOSYL)-
5-METHYL-1,3-DIAZABICYCLO[2.2.0]HEXAN-
2-ONE		A1QKG0.72
MNM(2S,3S,4R,5R)-2,3,4-TRIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE		A2ALW0.71
YX12-deoxy-2-{[(2-hydroxy-1-methylhydrazino)carbonyl]amino}-
beta-D-glucopyranose		A,B2VUR0.7
4GPN-(BETA-D-GLUCOPYRANOSYL)OXAMIC ACIDA2F3P0.72
CR11-DEOXY-1-METHOXYCARBAMIDO-BETA-
D-GLUCOPYRANOSE		A1FU70.78
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A,B2J750.71
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A2V3G0.71
NOY(2R,3S,4R,5R)-5-(HYDROXYMETHYL)PIPERIDINE-
2,3,4-TRIOL		A,B2VQU0.71
NTFN-TRIFLURO-ACETYL-BETA-D-GLUCOPYRANOSYLAMINEA1WW30.76
NCW(1S,2R,3S,4R,5R)-2,3,4-trihydroxy-
N-octyl-6-oxa-8-azabicyclo[3.2.1]octane-
8-carbothioamide		A,B2VRJ0.74
5UD5-FLUOROURIDINEA,B1TGV0.73
5UD5-FLUOROURIDINEA,B,C,D,E,F,
I,J,K,L		1RXC0.73
64T5-HYDROXY-THYMIDINE-5'-MONOPHOSPHATEA,C3CVU0.76
64T5-HYDROXY-THYMIDINE-5'-MONOPHOSPHATEA,L1KEG0.76
64T5-HYDROXY-THYMIDINE-5'-MONOPHOSPHATEA,G3EI10.76
64T5-HYDROXY-THYMIDINE-5'-MONOPHOSPHATEA1QKG0.76
64T5-HYDROXY-THYMIDINE-5'-MONOPHOSPHATEA1CFL0.76
2DFN-(2-DEOXY-BETA-D-ERYTHO-PENTOFURANOSYL-
5-PHOSPHATE) FORMAMIDE		B1OSR0.72
ADT3'-DEOXY-3'-ACETAMIDO-THYMIDINEA,B8RSA0.71
IFG(2R,3R,4S,5R)-2-ACETAMIDO-3,4-DIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE		A1JAK0.78
IFG(2R,3R,4S,5R)-2-ACETAMIDO-3,4-DIHYDROXY-
5-HYDROXYMETHYL-PIPERIDINE		A,B1NOW0.78
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A2JCQ0.72
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B2IH90.72
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A,B,C,D,E,F2J2P0.72
5AX2-(ACETYLAMINO)-1,5-ANHYDRO-2-DEOXY-
D-GLUCITOL		A3DIV0.72
KIFKIFUNENSINEA1FO30.72
KIFKIFUNENSINEA1PS30.72
KIFKIFUNENSINEA,B1KRF0.72
ADU3'-DEOXY-3'-ACETAMIDO-URIDINEA,B9RSA0.73
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE		A2BWM0.73
SNGMETHYL 2-ACETAMIDO-1,2-DIDEOXY-
1-SELENO-BETA-D-GLUCOPYRANOSIDE		A1O9V0.73
233[5-(3,4,5-TRIHYDROXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-2-YLCARBAMOYL)-
PENTYL]-CARBAMIC ACID METHYL ESTER		D,E,F,G,H1MD20.75
AZCA1KTI0.83
GYUGLYCOSYLURETHANA,B2UWG0.71
5HT5-HYDROXY-THYMIDINEA1EHL0.82
STZSTREPTOZOTOCINA2W4X0.71
T3S5'-deoxy-5'-piperidin-1-ylthymidineA3D8Y0.71
THUTETRAHYDRODEOXYURIDINEA,B1JTK0.85
THUTETRAHYDRODEOXYURIDINEA,B1UX00.85
THUTETRAHYDRODEOXYURIDINEA,B,C,D1UX10.85
THUTETRAHYDRODEOXYURIDINEA,B1UWZ0.85
FMU5-FLUORO-5-METHYLURIDINE-5'-MONOPHOSPHATEA,B,C,D2BH20.78
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5Q0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEM0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5R0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EXV0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L5S0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1L7X0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA1WW20.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA2PRJ0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1FC00.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEJ0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3CEH0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1XOI0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDW0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B1EM60.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DDS0.79
NBG1-N-ACETYL-BETA-D-GLUCOSAMINEA,B3DD10.79
8GPA2F3U0.74
DL62-AZIDO-N-((2R,3R,4S,5S,6R)-3,4,5-
TRIHYDROXY-6-(HYDROXYMETHYL)-TETRAHYDRO-
2H-PYRAN-2-YL)ACETAMIDE		A2FFR0.76
2OMA,B,C,D,E,F,
G,H,I,J,K,L,M		3G1F0.72
ZEB4-HYDROXY-3,4-DIHYDRO-ZEBULARINEA1CTU0.78
7GPETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3S0.71
URIURIDINEA,B,C,D,E,F,G1LNX0.73
URIURIDINEA,B,C,H1I5L0.73
URIURIDINEA,B,C,D2FR60.73
URIURIDINEA,B1TLZ0.73
URIURIDINEA2V0L0.73
URIURIDINEA,B,C,D,E,F2HWU0.73
URIURIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N		1LOJ0.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B1C2T0.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B,C,D1RBY0.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B,C,D1CDE0.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B1C3E0.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B,C1MEN0.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B1KJ80.73
GARGLYCINAMIDE RIBONUCLEOTIDEA,B1EZ10.73
NOZ(2S,3S,4R,5R)-5-(hydroxymethyl)piperidine-
2,3,4-triol		A,B2VL40.71
RDD1-beta-D-ribofuranosyl-1,3,5-triazinane-
2,4,6-trione		A3BD60.89
NOK2-ACETAMIDO-1,2-DIDEOXYNOJIRMYCINA2VC90.71
TYUTETRAHYDROURIDINEA,B,C,D2FR51
C494-THIO,5-FLUORO,5-METHYL-2'-DEOXY-
CYTIDINE-5'-MONOPHOSPHATE		A,B,F,G,M,N1DCT0.71
U3S1-(5-deoxy-5-piperidin-1-yl-alpha-
L-arabinofuranosyl)pyrimidine-2,4(1H,3H)-
dione		A3D6Q0.73
BMQA,B,C,D1EIX0.81
C4B1-beta-D-glucopyranosyl-1,3,5-triazinane-
2,4,6-trione		A3BDA0.8
PBT[3-HYDROXY-5-(5-METHYL-2,4-DIOXOTETRAHYDRO-
1(2H)-PYRIMIDINYL)TETRAHYDRO-2-
FURANYL]METHYL DIHYDROGEN PHOSPHATE		A1QL50.77
TTIA3FA10.77
BRD1-BETA-RIBOFURANOSYL-1,3-DIAZEPINONEA,B1MQ00.76
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL		A,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R		2HIL0.76
DT62,4-BIS(ACETYLAMINO)-1,5-ANHYDRO-
2,4-DIDEOXY-D-GLUCITOL		A2HI20.76
6GPMETHYL-N-(BETA-D-GLUCOPYRANOSYL)OXAMATEA2F3Q0.7
CTG(5R,6S)-5,6-DIHYDRO-5,6-DIHYDROXYTHYMIDINE-
5'-MONOPHOSPHATE		A,B,C,D,E,G,
I,K		2DY40.74
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEO1EG00.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEB,C,D1JGO0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEC,D2FMT0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA4TRA0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEE,F1SZ10.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA1TN20.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,C,E,F486D0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEB,C,D1JGP0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA1EVV0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATE0,Y,Z2OW80.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEC,D1EFW0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B,C,D1IL20.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA3CW60.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B3DEG0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA2V0J0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B1OB20.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA1TRA0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA3CW50.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEC,D1MJ10.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA3TRA0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEB1F7V0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA1YFG0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEB,C,D1JGQ0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEB1ML50.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEZ3BBV0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B,C,D,E,F1TTT0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATER,S1ASY0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEP,R1B230.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B,C,D,E1FCW0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B,C,D,E,F1OB50.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B1F7U0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA2Z9Q0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEB,C,D1GIX0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATET1GSG0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B1C0A0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B1QF60.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEM2OM70.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA2TRA0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B,R,S1ASZ0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA1EHZ0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA1FIR0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA6TNA0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,M		3G1H0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATET1SER0.82
H2U5,6-DIHYDROURIDINE-5'-MONOPHOSPHATEA4TNA0.82
FGRN-(N-FORMYLGLYCYL)-5-O-PHOSPHONO-
BETA-D-RIBOFURANOSYLAMINE		A2HS30.73
FGRN-(N-FORMYLGLYCYL)-5-O-PHOSPHONO-
BETA-D-RIBOFURANOSYLAMINE		A2HS40.73
U2S1-(5-deoxy-5-morpholin-4-yl-alpha-
L-arabinofuranosyl)pyrimidine-2,4(1H,3H)-
dione		A3D6P0.73
64P5-aminothymidine 5'-(dihydrogen phosphate)A,C2WB20.73