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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03215334

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AC01-PHENYLETHANONEA1ZK10.78
AC01-PHENYLETHANONEA1ZK40.78
MQ7MENAQUINONE-7C,H,L,M1PRC0.77
MQ7MENAQUINONE-7A,B,D,M,N,P2B760.77
MQ7MENAQUINONE-7C,H,L,M5PRC0.77
MQ7MENAQUINONE-7C,H,L,M7PRC0.77
MQ7MENAQUINONE-7C,H,L,M2PRC0.77
MQ7MENAQUINONE-7C,H,L,M1R2C0.77
MQ7MENAQUINONE-7A,B,C,E,F,G2VPW0.77
MQ7MENAQUINONE-7C,H,L,M3PRC0.77
MQ7MENAQUINONE-7A,B,D,M,N,O,P1L0V0.77
MQ7MENAQUINONE-7C,H,L,M2JBL0.77
MQ7MENAQUINONE-7C,H,L,M6PRC0.77
HPQHOMOPHENYLALANINYLMETHANEB1EWP0.73
BZQDIPHENYLMETHANONEA,B1GT50.82
BZQDIPHENYLMETHANONEA,B1DZP0.82
BDBA,B1KE30.74
PQNPHYLLOQUINONEA,B,C,F,I,J,
K,L,M,X
1JB00.79
PQNPHYLLOQUINONE1,2,3,4,A,B,
C,F,G,H,I,J,
K,L
2O010.79
PQNPHYLLOQUINONEA,B,C,F,K,L2PPS0.79
PQNPHYLLOQUINONEA,B,C,F,K,L1C510.79
PQNPHYLLOQUINONE0,1,2,3,4,5,
6,7,8,9,A,B,
C,F,G,H,J,K,
L,P,Q,R,U,V,
W,Z
1QZV0.79
FLPFLURBIPROFENA,B,C,D3PGH0.72
FLPFLURBIPROFENA,B1CQE0.72
FLPFLURBIPROFENA,B1EQH0.72
FLPFLURBIPROFENA,B2AYL0.72
FLPFLURBIPROFENA1DVT0.72
FLPFLURBIPROFENA1R9O0.72
OXEORTHO-XYLENEA,B3E0X0.73
OXEORTHO-XYLENEA188L0.73
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.81
ANQACENAPHTHENEQUINONEH,J1OAX0.81
MQ9MENAQUINONE-9C,H,L,M3D380.77
MQ9MENAQUINONE-9C,H,L,M1VRN0.77
MQ9MENAQUINONE-9C,H,L,M2I5N0.77
MQ9MENAQUINONE-9C,H,L,M,U1DXR0.77
DMW2,3-DIMETHYL-1,4-NAPHTHOQUINONEA,B,C,D,E,F2BS40.77
TRZTRAZEOLIDEA1C120.71
DPHDEAMINO-METHYL-PHENYLALANINEA1OS00.73
DPHDEAMINO-METHYL-PHENYLALANINEA,B2JJI0.73
DPHDEAMINO-METHYL-PHENYLALANINEA,B2JJJ0.73
DPHDEAMINO-METHYL-PHENYLALANINEA,B2VS20.73
DPHDEAMINO-METHYL-PHENYLALANINEA,B1OD10.73
DPHDEAMINO-METHYL-PHENYLALANINEE1EPR0.73
1LPTRANYLCYPROMINEA,B1OJB0.8
MQ8MENAQUINONE 8C,H,L,M1EYS0.77
NPYNAPHTHALENEA,B1O7G0.72
PHMPHENYLALANYLMETHANEA,I1PJP0.71
PHMPHENYLALANYLMETHANEA,B,C2J9J0.71
PHMPHENYLALANYLMETHANEA,B,C2JE40.71
FL2FLURBIPROFEN METHYL ESTERA,B1HT50.74
IBPIBUPROFENA3FKX0.7
IBPIBUPROFENA,B2BXG0.7
IBPIBUPROFENA,B1EQG0.7
IBPIBUPROFENA,B,C2WD90.7
IBPIBUPROFENA2PWS0.7
FPRPROPYLBENZENEC1RHK0.7
HBC(2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT-
2-YL)-PHENYL-METHANONE
H1JGU0.73
DENINDENEA183L0.72
GROR-2-PHENYL-PROPRIONIC ACIDB1K5S0.72
GROR-2-PHENYL-PROPRIONIC ACIDB1KEC0.72
GROR-2-PHENYL-PROPRIONIC ACIDB1K7D0.72
I4BISOBUTYLBENZENEA184L0.73
AN13-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACIDH,Y1LO30.7
DFADIPHENYLACETIC ACIDA,B,C1GMY0.74
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.78
PPT3-(P-TOLYL)PROPIONIC ACIDA,B2AY40.71
9TA1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-
ETHYLAMINO]-ANTHRAQUINONE
A,B1FDG0.79
5PV5-PHENYLVALERIC ACIDA,B2AY90.71
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.73
3PL3-PHENYLPROPANALE1Y3G0.77
HY1PHENYLACETALDEHYDED,H2I0S0.76
HY1PHENYLACETALDEHYDEA,B1D6Y0.76
HY1PHENYLACETALDEHYDEA,B1D6Z0.76
HY1PHENYLACETALDEHYDED,H2OK40.76
HY1PHENYLACETALDEHYDEA,B1D6U0.76
PYLPHENYLETHANEC1B070.7
PYLPHENYLETHANEA,B2VRM0.7
PYLPHENYLETHANEA1NHB0.7
BFLA,B1Q4G0.74
N4BN-BUTYLBENZENEA186L0.7
KPV5-PHENYL-2-KETO-VALERIC ACIDA,B2Q5Q0.71
VK3MENADIONEA1TUV0.77
VK3MENADIONEA,B2QR20.77