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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00769913

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ANQACENAPHTHENEQUINONEH,J1OAX0.81
PQNPHYLLOQUINONEA,B,C,F,I,J,
K,L,M,X
1JB00.87
PQNPHYLLOQUINONE1,2,3,4,A,B,
C,F,G,H,I,J,
K,L
2O010.87
PQNPHYLLOQUINONEA,B,C,F,K,L2PPS0.87
PQNPHYLLOQUINONEA,B,C,F,K,L1C510.87
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
1QZV0.87
VK3MENADIONEA1TUV0.83
VK3MENADIONEA,B2QR20.83
MQ8MENAQUINONE 8C,H,L,M1EYS0.85
MQ9MENAQUINONE-9C,H,L,M3D380.85
MQ9MENAQUINONE-9C,H,L,M1VRN0.85
MQ9MENAQUINONE-9C,H,L,M2I5N0.85
MQ9MENAQUINONE-9C,H,L,M,U1DXR0.85
ELI6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN-
2-YL)HEXANOIC ACID
A,B2GH50.76
HY1PHENYLACETALDEHYDED,H2I0S0.7
HY1PHENYLACETALDEHYDEA,B1D6Y0.7
HY1PHENYLACETALDEHYDEA,B1D6Z0.7
HY1PHENYLACETALDEHYDED,H2OK40.7
HY1PHENYLACETALDEHYDEA,B1D6U0.7
MQ7MENAQUINONE-7C,H,L,M1PRC0.85
MQ7MENAQUINONE-7A,B,D,M,N,P2B760.85
MQ7MENAQUINONE-7C,H,L,M5PRC0.85
MQ7MENAQUINONE-7C,H,L,M7PRC0.85
MQ7MENAQUINONE-7C,H,L,M2PRC0.85
MQ7MENAQUINONE-7C,H,L,M1R2C0.85
MQ7MENAQUINONE-7A,B,C,E,F,G2VPW0.85
MQ7MENAQUINONE-7C,H,L,M3PRC0.85
MQ7MENAQUINONE-7A,B,D,M,N,O,P1L0V0.85
MQ7MENAQUINONE-7C,H,L,M2JBL0.85
MQ7MENAQUINONE-7C,H,L,M6PRC0.85
DFADIPHENYLACETIC ACIDA,B,C1GMY0.71
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.82
HPK(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATEA2PUH0.76
9TA1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-
ETHYLAMINO]-ANTHRAQUINONE
A,B1FDG0.87
825[{2-bromo-4-[(2R)-3-oxo-2,3-diphenylpropyl]phenyl}(difluoro)methyl]phosphonic acidA3CWE0.71
HPZ(2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-
2,4-DIENOIC ACID
A2PUJ0.7
KTP(2-NAPHTHALEN-2-YL-1-NAPHTHALEN-
1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID
A,B1KYN0.75
1LPTRANYLCYPROMINEA,B1OJB0.73
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.75
HBC(2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT-
2-YL)-PHENYL-METHANONE
H1JGU0.82
AC01-PHENYLETHANONEA1ZK10.8
AC01-PHENYLETHANONEA1ZK40.8
HBXbenzaldehydeA,B3GDN0.72
HPX(2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-
2,4-DIENOIC ACID
A,B,C,D2DSA0.7
TRZTRAZEOLIDEA1C120.73
BZQDIPHENYLMETHANONEA,B1GT50.86
BZQDIPHENYLMETHANONEA,B1DZP0.86
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B2OK90.71
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B1Z760.71
PBP1-(4-BROMO-PHENYL)-ETHANONEA1BK90.71
DMW2,3-DIMETHYL-1,4-NAPHTHOQUINONEA,B,C,D,E,F2BS40.83