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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03263388

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.7
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.7
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.73
5NS5-aminonaphthalene-1-sulfonic acidA,B3CFT0.71
34A3,4-DIMETHYLANILINEA1L4K0.84
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.7
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.8
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.78
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QJU0.77
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QB40.77
IXX3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-
N,N-DIMETHYLPROPAN-1-AMINE
A2Q720.76
PRY2-PROPYL-ANILINEA1OWY0.85
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.77
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.77
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.77
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.77
PBZP-AMINO BENZAMIDINEA,B2BDG0.75
PBZP-AMINO BENZAMIDINEA1RFN0.75
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.75
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.75
PBZP-AMINO BENZAMIDINEA1FIZ0.75
PBZP-AMINO BENZAMIDINEA1FIW0.75
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.75
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.78
CVICRYSTAL VIOLETA,B,D,E1JTX0.77
TTT5-amino-2-methyl-N-[(1R)-1-naphthalen-
1-ylethyl]benzamide
A3E9S0.7
ANCANTHRACEN-1-YLAMINEA,B1GT10.87
ANCANTHRACEN-1-YLAMINEA,B1HN20.87
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.82
XYD2,5-DIMETHYLANILINEA1L4L0.82
DR15-METHYL-5H-INDOLO[3,2-B]QUINOLINEA1K9G0.7
SBN2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILEA1JLQ0.7
ANLANILINEA2OV40.71
ANLANILINEA1AEE0.71
ANLANILINEA1PPA0.71
ANLANILINEA1HJ90.71
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.71
PNZP-NITRO-BENZYLAMINEA,B2C700.71
9AP9-AMINOPHENANTHRENEA1EGY0.88
AFF2-ACETYLAMINOFLUORENE-3-YLA2GE20.73
2CM2-CHLORO-6-METHYL-ANILINEA1OVH0.71
EBW4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-
3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-
2-ENYLBENZENAMINIUM
A1E3Q0.71
MGRMALACHITE GREENA,B3BQZ0.77
MGRMALACHITE GREENA1Q8N0.77
MGRMALACHITE GREENA,B3BR00.77
MGRMALACHITE GREENA,D,E3BTL0.77
MGRMALACHITE GREENA,B,D,E3BTC0.77
MGRMALACHITE GREENA,B,D,E1JUP0.77
ISOPARA-ISOPROPYLANILINEA1BMA0.88
ISOPARA-ISOPROPYLANILINEA,B1ELC0.88
ISOPARA-ISOPROPYLANILINEA,B1ELB0.88
ISOPARA-ISOPROPYLANILINEA,B1ELA0.88
BRNBERENILA,B268D0.74
BRNBERENILA,B1D630.74
BRNBERENILA,D,E2GBY0.74
BRNBERENILA2DBE0.74
BRNBERENILA2GVR0.74
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.81
N2M5-AMINO-NAPHTALENE-2-MONOSULFONATEC,D1HKN0.71
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.7
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.81
A8BA1ODC0.71
745TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE-
2-CARBOXAMIDINE
A1U6Q0.71