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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03357366

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.83
ISOPARA-ISOPROPYLANILINEA1BMA0.73
ISOPARA-ISOPROPYLANILINEA,B1ELC0.73
ISOPARA-ISOPROPYLANILINEA,B1ELB0.73
ISOPARA-ISOPROPYLANILINEA,B1ELA0.73
OSPSULTHIAMEA2Q1Q0.7
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.75
XYD2,5-DIMETHYLANILINEA1L4L0.75
5AN3,5-DIFLUOROANILINEA1LGX0.84
LJGN,N'-(iminodiethane-2,1-diyl)bis[4-
amino-N-(2-methylpropyl)benzenesulfonamide]
B3BGB0.71
NIT4-NITROANILINEC,D1RMH0.76
NIT4-NITROANILINEA,B,D,F,G,H,I2IXP0.76
NIT4-NITROANILINEB1VBS0.76
NIT4-NITROANILINEC1V9T0.76
NIT4-NITROANILINEC,D1VBT0.76
NIT4-NITROANILINEB1LOP0.76
NIT4-NITROANILINEC,D1ZKF0.76
NIT4-NITROANILINEB1PIP0.76
34A3,4-DIMETHYLANILINEA1L4K0.73
NP2N-(3-AMINOPROPYL)-2-NITROBENZENAMINEA1WUM0.7
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.79
U134-(4-FLUORO-PHENYLAZO)-5-IMINO-
5H-PYRAZOL-3-YLAMINE
A2GG30.73
1AN2-FLUOROANILINEA1LGW0.84
BSU1,3-DIPHENYLUREAA3E850.71
BSU1,3-DIPHENYLUREAA2ZJF0.71
PL01-phenylguanidineA2O8W0.71
URSN-PHENYLTHIOUREAA,B1BUG0.73
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.78
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.75
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.7
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.78
PRY2-PROPYL-ANILINEA1OWY0.76
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1K2T0.74
PTU2-ETHYL-1-PHENYL-ISOTHIOUREAA,B1D1V0.74
TFMS-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREAA,B1K2U0.71
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.75
T2D1,2,5-THIADIAZOLIDIN-3-ONE-1,1-
DIOXIDE
A2BGE0.76
1712-PHENYLAMINO-ETHANESULFONIC ACIDA,B1SXG0.74
PNDP-NITROPHENYLHYDRAZINEA,G1JMZ0.7
ROK4-AMINO-N-[(2-SULFANYLETHYL)CARBAMOYL]BENZENESULFONAMIDEA,B,C,D,E,F,
G,H
2VT50.72
PHZ1-PHENYLHYDRAZINEA2E2T0.76
PHZ1-PHENYLHYDRAZINED,H2AGL0.76
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA1S6R0.71
IAP4-IODO-ACETAMIDO PHENYLBORONIC ACIDA,B1K6S0.71
1MRN-METHYLANILINEX2OTZ0.8
SANSULFANILAMIDEA1AJ00.79
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.71
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.83
NBZNITROBENZENEA,B2BMQ0.72
NBZNITROBENZENEA,B3BGU0.72
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.76
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.76
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.76
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.76
PHJN-[(AMINOOXY)CARBONYL]-N-PHENYLAMINEA,B1UR90.74
NYLN-ALLYL-ANILINEA1OVK0.78
NBENITROSOBENZENEA1LH70.74
NBENITROSOBENZENEA2LH70.74
NBENITROSOBENZENEA2NSS0.74
264(phenylamino)acetonitrileA2RBN0.77
ANLANILINEA2OV40.8
ANLANILINEA1AEE0.8
ANLANILINEA1PPA0.8
ANLANILINEA1HJ90.8