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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01431362

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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		A3BGX0.72
1AA5'-O-[({[(2-{[(2-AMINOPHENYL)CARBONYL]OXY}ETHYL)OXY]PHOSPHINATO}OXY)PHOSPHINATO]CYTIDINEA,B,C,D,E,F2AMT0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1U1J0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2OGY0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1XPG0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1TLS0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B,C1ZP40.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2E7F0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1TSN0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2IDK0.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1XR20.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1B020.7
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1Q8J0.7
RXB(1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo-
1,2,3,4-tetrahydroisoquinolin-5-
yl)amino]ethyl acetate		A,B,C,D3DEI0.75
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B1TSD0.76
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B1SYN0.76
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B2VF00.76
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B,C,D,E1SEJ0.76
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B,C,D1F280.76
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B1TLC0.76
4216-CARBAMIMIDOYL-4-(3-HYDROXY-2-
METHYL-BENZOYLAMINO)-NAPHTHALENE-
2-CARBOXYLIC ACID METHYL ESTER		A1ZSK0.7
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
BL4(3aS)-3a-hydroxy-5-methyl-1-phenyl-
1,2,3,3a-tetrahydro-4H-pyrrolo[2,3-
b]quinolin-4-one		A3BZ70.78
7613-(OXALYL-AMINO)-NAPHTHALENE-2-
CARBOXYLIC ACID		A1C840.7
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1KCE0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1NCE0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E,F1KZJ0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDX2FTO0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TRG0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B2TSC0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TVU0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TVV0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1FWM0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1BQ10.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E3DL50.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1AIQ0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1DDU0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E1QZF0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1TDU0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1VZE0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B2G8M0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E2OIP0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1CI70.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1DNA0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1LCA0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1VZD0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1ZPR0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2AAZ0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B2G8O0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TVW0.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E3DL60.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1AN50.72
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D2BFA0.72
D16TOMUDEXA,B1I000.7
D16TOMUDEXA,B2KCE0.7
D16TOMUDEXA,B,C,D2TSR0.7
D16TOMUDEXA,B,C,D1HVY0.7
D16TOMUDEXA,B1RTS0.7
TMF5,10-METHYLENE-6-HYDROFOLIC ACIDA1BJG0.72
TMF5,10-METHYLENE-6-HYDROFOLIC ACIDA1JBW0.72
TMF5,10-METHYLENE-6-HYDROFOLIC ACIDA1LCE0.72
AXA(5S)-5-(2-amino-2-oxoethyl)-4-oxo-
N-[(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-
6-yl)methyl]-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-
d]pyrimidine-2-carboxamide		A,B3DNG0.7
BL6(3aS)-3a-hydroxy-7-methyl-1-phenyl-
1,2,3,3a-tetrahydro-4H-pyrrolo[2,3-
b]quinolin-4-one		A3BZ80.79
RXC(1S)-1-(3-chlorophenyl)-2-oxo-2-
[(1,3,4-trioxo-1,2,3,4-tetrahydroisoquinolin-
5-yl)amino]ethyl acetate		A,B,C,D3DEJ0.72
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B,C,D1EQB0.71
FFO5-FORMYL-6-HYDROFOLIC ACIDA1JOM0.71
FFO5-FORMYL-6-HYDROFOLIC ACIDA1PJ70.71
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B,C,D1DFO0.71
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B2VMY0.71
FFO5-FORMYL-6-HYDROFOLIC ACIDA,B1JOL0.71
FFO5-FORMYL-6-HYDROFOLIC ACIDA1WOP0.71
BIT(-)-1-PHENYL-1,2,3,4-TETRAHYDRO-
4-HYDROXYPYRROLO[2,3-B]-7-METHYLQUINOLIN-
4-ONE		A1YV30.79
DQB4-[(4-{[(2-AMINO-4-OXO-3,4-DIHYDROQUINAZOLIN-
6-YL)METHYL]AMINO}BENZOYL)AMINO]BUTANOIC ACID		A1ZLY0.73
NHS10-FORMYL-5,8,10-TRIDEAZAFOLIC ACIDA,B1C2T0.74
7123-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-
5-[METHYL(METHYLSULFONYL)AMINO]BENZYL ALPHA-
METHYL-D-PHENYLALANINATE		A2PH60.71
9892-{[4-(2-ACETYLAMINO-2-PENTYLCARBAMOYL-
ETHYL)-NAPHTHALEN-1-YL]-OXALYL-
AMINO}-BENZOIC ACID		A1NL90.72
MU1N~2~-ACETYL-N-[(1S,3S,4S)-4-({[(5S)-
3-(3-ACETYLPHENYL)-2-OXO-1,3-OXAZOLIDIN-
5-YL]CARBONYL}AMINO)-1-BENZYL-3-
HYDROXY-5-PHENYLPENTYL]-L-VALINAMIDE		A,B2Q540.71
FRM2-{3-[4-(4-FLUOROPHENYL)-3,6-DIHYDRO-
1(2H)-PYRIDINYL]PROPYL}-8-METHYL-
4(3H)-QUINAZOLINONE		A,B1UK00.7
BIJ7-{[(2Z,5S)-5-CHLORO-2-{[2-METHOXY-
4-(4-METHYLPIPERAZIN-1-YL)PHENYL]IMINO}-
2,5-DIHYDROPYRIMIDIN-4-YL]AMINO}-
2-METHYL-2,3-DIHYDRO-1H-ISOINDOL-
1-ONE		A2JKO0.72
RAC4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)-
BENZOIC ACID		H1MEX0.76
THF5-HYDROXYMETHYLENE-6-HYDROFOLIC ACIDA,B,C,D1EJI0.71
THF5-HYDROXYMETHYLENE-6-HYDROFOLIC ACIDA1U3G0.71
THF5-HYDROXYMETHYLENE-6-HYDROFOLIC ACIDA2TDD0.71
BL7(3aS)-3a-hydroxy-1-phenyl-1,2,3,3a-
tetrahydro-4H-pyrrolo[2,3-b]quinolin-
4-one		A3BZ90.77
XINmethyl (3Z)-3-{[(4-{methyl[(4-methylpiperazin-
1-yl)acetyl]amino}phenyl)amino](phenyl)methylidene}-
2-oxo-2,3-dihydro-1H-indole-6-carboxylate		A3C7Q0.76