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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02827124

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HY1PHENYLACETALDEHYDED,H2I0S0.73
HY1PHENYLACETALDEHYDEA,B1D6Y0.73
HY1PHENYLACETALDEHYDEA,B1D6Z0.73
HY1PHENYLACETALDEHYDED,H2OK40.73
HY1PHENYLACETALDEHYDEA,B1D6U0.73
1LPTRANYLCYPROMINEA,B1OJB0.76
9TA1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-
ETHYLAMINO]-ANTHRAQUINONE
A,B1FDG0.86
TRZTRAZEOLIDEA1C120.76
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.7
BZQDIPHENYLMETHANONEA,B1GT50.9
BZQDIPHENYLMETHANONEA,B1DZP0.9
173BENZOYL-FORMIC ACIDA,B1SZE0.7
HPZ(2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-
2,4-DIENOIC ACID
A2PUJ0.71
PQNPHYLLOQUINONEA,B,C,F,I,J,
K,L,M,X
1JB00.82
PQNPHYLLOQUINONE1,2,3,4,A,B,
C,F,G,H,I,J,
K,L
2O010.82
PQNPHYLLOQUINONEA,B,C,F,K,L2PPS0.82
PQNPHYLLOQUINONEA,B,C,F,K,L1C510.82
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
1QZV0.82
DMW2,3-DIMETHYL-1,4-NAPHTHOQUINONEA,B,C,D,E,F2BS40.85
HPX(2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA-
2,4-DIENOIC ACID
A,B,C,D2DSA0.71
HBXbenzaldehydeA,B3GDN0.76
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.78
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.86
MQ8MENAQUINONE 8C,H,L,M1EYS0.82
BFLA,B1Q4G0.7
VK3MENADIONEA1TUV0.85
VK3MENADIONEA,B2QR20.85
AC01-PHENYLETHANONEA1ZK10.87
AC01-PHENYLETHANONEA1ZK40.87
ANQACENAPHTHENEQUINONEH,J1OAX0.91
ELI6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN-
2-YL)HEXANOIC ACID
A,B2GH50.74
3PL3-PHENYLPROPANALE1Y3G0.72
HBC(2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT-
2-YL)-PHENYL-METHANONE
H1JGU0.76
HPK(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATEA2PUH0.77
MQ7MENAQUINONE-7C,H,L,M1PRC0.82
MQ7MENAQUINONE-7A,B,D,M,N,P2B760.82
MQ7MENAQUINONE-7C,H,L,M5PRC0.82
MQ7MENAQUINONE-7C,H,L,M7PRC0.82
MQ7MENAQUINONE-7C,H,L,M2PRC0.82
MQ7MENAQUINONE-7C,H,L,M1R2C0.82
MQ7MENAQUINONE-7A,B,C,E,F,G2VPW0.82
MQ7MENAQUINONE-7C,H,L,M3PRC0.82
MQ7MENAQUINONE-7A,B,D,M,N,O,P1L0V0.82
MQ7MENAQUINONE-7C,H,L,M2JBL0.82
MQ7MENAQUINONE-7C,H,L,M6PRC0.82
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B2OK90.76
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B1Z760.76
PBP1-(4-BROMO-PHENYL)-ETHANONEA1BK90.76
MQ9MENAQUINONE-9C,H,L,M3D380.82
MQ9MENAQUINONE-9C,H,L,M1VRN0.82
MQ9MENAQUINONE-9C,H,L,M2I5N0.82
MQ9MENAQUINONE-9C,H,L,M,U1DXR0.82
DFADIPHENYLACETIC ACIDA,B,C1GMY0.7
KTP(2-NAPHTHALEN-2-YL-1-NAPHTHALEN-
1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID
A,B1KYN0.74