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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01940202

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BFBN-[(1S)-1-(AMINOCARBONYL)-4-(ETHANIMIDOYLAMINO)BUTYL]BENZAMIDEA2DW50.72
TGF2-[4-(4-{4-[(2-AMINO-5-FORMYL-4-
OXO-3,4,5,6,7,8-HEXAHYDRO-PTERIDIN-
6-YLMETHYL)-AMINO]-BENZOYLAMINO}-
4-CARBOXY-BUTYRYLAMINO)-4-CARBOXY-
BUTYRYLAMINO]-PENTANEDIOIC ACID
A,B,C,D1LS30.73
XXZ1-[4-(AMINOMETHYL)BENZOYL]-5'-FLUORO-
1'H-SPIRO[PIPERIDINE-4,2'-QUINAZOLIN]-
4'-AMINE
A,B3E650.72
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA,B1KZI0.75
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA1M7Z0.75
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA3BHR0.75
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA3GSI0.75
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA1M7V0.75
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA,B3BHL0.75
THG(6S)-5,6,7,8-TETRAHYDROFOLATEA1U220.75
MHF5,10-METHENYL-6,7,8-TRIHYDROFOLIC ACIDX2IJG0.72
MHF5,10-METHENYL-6,7,8-TRIHYDROFOLIC ACIDA,B2J4D0.72
MHF5,10-METHENYL-6,7,8-TRIHYDROFOLIC ACIDA,B1DNP0.72
U1N4-[(3R)-3-{[2-(4-FLUOROPHENYL)-
2-OXOETHYL]AMINO}BUTYL]BENZAMIDE
A,B2OGZ0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1U1J0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2OGY0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1XPG0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1TLS0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B,C1ZP40.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2E7F0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1TSN0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2IDK0.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1XR20.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1B020.75
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1Q8J0.75
BAGN-[(E)-2-AMINO-1-(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)-
2-HYDROXYVINYL]BENZAMIDE
A1WDA0.79
MEFN-({4-[(6aR)-3-amino-1-oxo-1,2,5,6,6a,7-
hexahydroimidazo[1,5-f]pteridin-
8(9H)-yl]phenyl}carbonyl)-L-glutamic acid
A3BGX0.73
THF5-HYDROXYMETHYLENE-6-HYDROFOLIC ACIDA,B,C,D1EJI0.7
THF5-HYDROXYMETHYLENE-6-HYDROFOLIC ACIDA1U3G0.7
THF5-HYDROXYMETHYLENE-6-HYDROFOLIC ACIDA2TDD0.7
FONFOLINIC ACIDA,B1QD10.74
FONFOLINIC ACIDA,B2BLN0.74
FONFOLINIC ACIDA,B,C,D1VRQ0.74
FONFOLINIC ACIDA,B1KL20.74
FONFOLINIC ACIDA,B1XZQ0.74
SY12-({2-[(3R)-3-AMINOPIPERIDIN-1-
YL]-4-OXOQUINAZOLIN-3(4H)-YL}METHYL)BENZONITRILE
A,B,C,D2ONC0.73
FRM2-{3-[4-(4-FLUOROPHENYL)-3,6-DIHYDRO-
1(2H)-PYRIDINYL]PROPYL}-8-METHYL-
4(3H)-QUINAZOLINONE
A,B1UK00.74
THLN-[4-({[(6S)-2-AMINO-4-OXO-1,4,5,6,7,8-
HEXAHYDROPTERIDIN-6-YL]METHYL}AMINO)BENZOYL]-
L-GLUTAMIC ACID
A3G5R0.75
THLN-[4-({[(6S)-2-AMINO-4-OXO-1,4,5,6,7,8-
HEXAHYDROPTERIDIN-6-YL]METHYL}AMINO)BENZOYL]-
L-GLUTAMIC ACID
A1WOO0.75
NDLN-BENZOYL-L-NORLEUCYL-L-LYSYL-L-
ARGINYL-L-ARGININE
B2FP70.7
AQO2-AMINOQUINAZOLIN-4(3H)-ONEA1S390.73
XX43-(2-AMINO-6-BENZOYLQUINAZOLIN-
3(4H)-YL)-N-CYCLOHEXYL-N-METHYLPROPANAMIDE
A,B,C2Q110.72
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RX60.76
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RX50.76
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RX40.76
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA,B1DYJ0.76
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RC40.76
MAQ2-AMINO-8-METHYLQUINAZOLIN-4(3H)-
ONE
A1S380.71
DQB4-[(4-{[(2-AMINO-4-OXO-3,4-DIHYDROQUINAZOLIN-
6-YL)METHYL]AMINO}BENZOYL)AMINO]BUTANOIC ACID
A1ZLY0.72
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B,C,D1EQB0.7
FFO5-FORMYL-6-HYDROFOLIC ACIDA1JOM0.7
FFO5-FORMYL-6-HYDROFOLIC ACIDA1PJ70.7
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B,C,D1DFO0.7
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B2VMY0.7
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B1JOL0.7
FFO5-FORMYL-6-HYDROFOLIC ACIDA1WOP0.7
DHFDIHYDROFOLIC ACIDA,B,C,D,E3DL50.73
DHFDIHYDROFOLIC ACIDA1LCB0.73
DHFDIHYDROFOLIC ACIDA,B,C,D1MXH0.73
DHFDIHYDROFOLIC ACIDA2RK10.73
DHFDIHYDROFOLIC ACIDA1RF70.73
DHFDIHYDROFOLIC ACIDA,B,C,D,E3DL60.73
DHFDIHYDROFOLIC ACIDA1TYS0.73