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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02463613

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CF4[4-(7,8-dimethyl-2,4-dioxo-3,4-
dihydrobenzo[g]pteridin-10(2H)-
yl)butyl]carbamic acid		A2VKG0.72
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1U1J0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2OGY0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1XPG0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1TLS0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B,C1ZP40.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2E7F0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1TSN0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B2IDK0.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1XR20.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA1B020.95
C2F5-METHYL-5,6,7,8-TETRAHYDROFOLIC ACIDA,B1Q8J0.95
4HFN-[(5-{2-[(6R)-2-AMINO-4-OXO-3,4,5,6,7,8-
HEXAHYDROPYRIDO[2,3-D]PYRIMIDIN-
6-YL]ETHYL}-2-THIENYL)CARBONYL]-
L-GLUTAMIC ACID		A,B,C2FMN0.74
BW2N-(4-{[(2-AMINO-4-OXO-3,4-DIHYDROQUINAZOLIN-
6-YL)AMINO]SULFONYL}BENZOYL)GLUTAMIC ACID		A,B,C,D1PL00.8
CHYCHYMOSTATINA,B1M210.71
CHYCHYMOSTATINA,B1WVM0.71
AAFMETHYL 4-{[({[(2R,5S)-5-{[(2S)-
2-(AMINOMETHYL)PYRROLIDIN-1-YL]CARBONYL}PYRROLIDIN-
2-YL]METHYL}AMINO)CARBONYL]AMINO}BENZOATE		B2G630.7
F42COENZYME F420A1RHC0.73
F42COENZYME F420A,B1JAY0.73
F42COENZYME F420A,B3B4Y0.73
F42COENZYME F420A,B,C,D1Z690.73
EOT[(1-[(BIS-CARBOXYMETHYL-AMINO)-
METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)-
THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL-
AMINO]-ACETIC ACID		H1INE0.7
EOT[(1-[(BIS-CARBOXYMETHYL-AMINO)-
METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)-
THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL-
AMINO]-ACETIC ACID		H1IND0.7
DZF5-DEAZAFOLIC ACIDA,B2DHF0.78
DZF5-DEAZAFOLIC ACIDA,B1DYH0.78
DZF5-DEAZAFOLIC ACIDA,B,C,D1CDE0.78
4DP3-[5-(DIMETHYLAMINO)-1,3-DIOXO-
1,3-DIHYDRO-2H-ISOINDOL-2-YL]-L-
ALANINE		C2IPK0.7
CST[[PHENYLALANINE-CARBONYL-AMINO-
2-(2-AMINO-1,4,5,6-TETRAHYDRO-PYRIMIDIN-
4-YL)-1-ACETALDEHYDYL]-2-ISOBUTYL-
GLYCYL]PHENYLALANINE		A,B1BCS0.71
CST[[PHENYLALANINE-CARBONYL-AMINO-
2-(2-AMINO-1,4,5,6-TETRAHYDRO-PYRIMIDIN-
4-YL)-1-ACETALDEHYDYL]-2-ISOBUTYL-
GLYCYL]PHENYLALANINE		A1SGC0.71
DQB4-[(4-{[(2-AMINO-4-OXO-3,4-DIHYDROQUINAZOLIN-
6-YL)METHYL]AMINO}BENZOYL)AMINO]BUTANOIC ACID		A1ZLY0.84
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B1TSD0.78
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B1SYN0.78
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B2VF00.78
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,E1SEJ0.78
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,D1F280.78
F89S)-2-(5(((1,2-DIHYDRO-3-METHYL-
1-OXOBENZO(F)QUINAZOLIN-9-YL)METHYL)AMINO)1-
OXO-2-ISOINDOLINYL)GLUTARIC ACID		A,B1TLC0.78
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE		A,B3F060.72
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE		A,B3EZP0.72
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE		A3EW80.72
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE		A,B3EZT0.72
B3N4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-
N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE		A1T670.72
DHFDIHYDROFOLIC ACIDA,B,C,D,E3DL50.92
DHFDIHYDROFOLIC ACIDA1LCB0.92
DHFDIHYDROFOLIC ACIDA,B,C,D1MXH0.92
DHFDIHYDROFOLIC ACIDA2RK10.92
DHFDIHYDROFOLIC ACIDA1RF70.92
DHFDIHYDROFOLIC ACIDA,B,C,D,E3DL60.92
DHFDIHYDROFOLIC ACIDA1TYS0.92
26BO-tert-butyl-N-[(3-{[(2,4,6-trimethylphenyl)carbamoyl]amino}naphthalen-
2-yl)carbonyl]-L-threonine		A,B3DDS0.71
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RX60.83
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RX50.83
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RX40.83
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA,B1DYJ0.83
DDF5,10-DIDEAZATETRAHYDROFOLIC ACIDA1RC40.83
D16TOMUDEXA,B1I000.76
D16TOMUDEXA,B2KCE0.76
D16TOMUDEXA,B,C,D2TSR0.76
D16TOMUDEXA,B,C,D1HVY0.76
D16TOMUDEXA,B1RTS0.76
23IN-[(1S,2S,4R)-2-HYDROXY-1-ISOBUTYL-
5-({(1S)-1-[(ISOPROPYLAMINO)CARBONYL]-
2-METHYLPROPYL}AMINO)-4-METHYL-
5-OXOPENTYL]-5-[METHYL(METHYLSULFONYL)AMINO]-
N'-[(1R)-1-PHENYLETHYL]ISOPHTHALAMIDE		A,B,C,D2P4J0.73
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1KCE0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1NCE0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E,F1KZJ0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDX2FTO0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TRG0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B2TSC0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TVU0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TVV0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1FWM0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1BQ10.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E3DL50.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1AIQ0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1DDU0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E1QZF0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1TDU0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1VZE0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B2G8M0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E2OIP0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1CI70.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1DNA0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1LCA0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1VZD0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1ZPR0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2AAZ0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B2G8O0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA1TVW0.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D,E3DL60.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B1AN50.87
CB310-PROPARGYL-5,8-DIDEAZAFOLIC ACIDA,B,C,D2BFA0.87