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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01083147

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2CM2-CHLORO-6-METHYL-ANILINEA1OVH0.72
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.71
PBZP-AMINO BENZAMIDINEA,B2BDG0.77
PBZP-AMINO BENZAMIDINEA1RFN0.77
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.77
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.77
PBZP-AMINO BENZAMIDINEA1FIZ0.77
PBZP-AMINO BENZAMIDINEA1FIW0.77
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.77
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.78
IS2[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACIDA1O4J0.72
1AN2-FLUOROANILINEA1LGW0.7
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.78
PNZP-NITRO-BENZYLAMINEA,B2C700.78
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.8
TFMS-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREAA,B1K2U0.72
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.7
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.72
SANSULFANILAMIDEA1AJ00.73
NBZNITROBENZENEA,B2BMQ0.71
NBZNITROBENZENEA,B3BGU0.71
2631-(azidomethyl)-3-methylbenzeneX2RB20.72
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.7
ANLANILINEA2OV40.73
ANLANILINEA1AEE0.73
ANLANILINEA1PPA0.73
ANLANILINEA1HJ90.73
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.77
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.79
ISOPARA-ISOPROPYLANILINEA1BMA0.8
ISOPARA-ISOPROPYLANILINEA,B1ELC0.8
ISOPARA-ISOPROPYLANILINEA,B1ELB0.8
ISOPARA-ISOPROPYLANILINEA,B1ELA0.8
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.8
XYD2,5-DIMETHYLANILINEA1L4L0.8
PRY2-PROPYL-ANILINEA1OWY0.81
BRNBERENILA,B268D0.7
BRNBERENILA,B1D630.7
BRNBERENILA,D,E2GBY0.7
BRNBERENILA2DBE0.7
BRNBERENILA2GVR0.7
TNL2,4,6-TRINITROTOLUENEA1GVR0.77
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.72
34A3,4-DIMETHYLANILINEA1L4K0.8
NBENITROSOBENZENEA1LH70.73
NBENITROSOBENZENEA2LH70.73
NBENITROSOBENZENEA2NSS0.73
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.71
3NT3-NITROTOLUENEA,B2BMR0.79
3NT3-NITROTOLUENEA,B2HMO0.79
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.78
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.92
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.8
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.79
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.79
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.79
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.79
NPB3-NITROPHENYLBORONIC ACIDA,B1KDS0.71