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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03099709

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
BZQDIPHENYLMETHANONEA,B1GT50.82
BZQDIPHENYLMETHANONEA,B1DZP0.82
5PV5-PHENYLVALERIC ACIDA,B2AY90.7
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
PAC2-PHENYLACETIC ACIDB1PNL0.71
PAC2-PHENYLACETIC ACIDB1K5Q0.71
PAC2-PHENYLACETIC ACIDB1FXH0.71
PAC2-PHENYLACETIC ACIDA2ISF0.71
PAC2-PHENYLACETIC ACIDA2INE0.71
PPY3-PHENYLPYRUVIC ACIDA,B2Q5O0.73
PPY3-PHENYLPYRUVIC ACIDA,B1LCO0.73
PPY3-PHENYLPYRUVIC ACIDA,B,C,D,E,F2ZF40.73
PPY3-PHENYLPYRUVIC ACIDA,B1BW90.73
MQ8MENAQUINONE 8C,H,L,M1EYS0.77
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.71
BP4BIPHENYL-4-YL-ACETALDEHYDEA,B,E,F,G,H1MHW0.8
HPQHOMOPHENYLALANINYLMETHANEB1EWP0.7
VK3MENADIONEA1TUV0.81
VK3MENADIONEA,B2QR20.81
FL2FLURBIPROFEN METHYL ESTERA,B1HT50.73
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B2OK90.7
PBP1-(4-BROMO-PHENYL)-ETHANONEA,B1Z760.7
PBP1-(4-BROMO-PHENYL)-ETHANONEA1BK90.7
HBXbenzaldehydeA,B3GDN0.71
CLT4-PHENYL-BUTANOIC ACIDA1THL0.7
CLT4-PHENYL-BUTANOIC ACIDA,B2AY70.7
CLT4-PHENYL-BUTANOIC ACIDE,I1TMN0.7
OXEORTHO-XYLENEA,B3E0X0.72
OXEORTHO-XYLENEA188L0.72
FLPFLURBIPROFENA,B,C,D3PGH0.73
FLPFLURBIPROFENA,B1CQE0.73
FLPFLURBIPROFENA,B1EQH0.73
FLPFLURBIPROFENA,B2AYL0.73
FLPFLURBIPROFENA1DVT0.73
FLPFLURBIPROFENA1R9O0.73
PQNPHYLLOQUINONEA,B,C,F,I,J,
K,L,M,X
1JB00.77
PQNPHYLLOQUINONE1,2,3,4,A,B,
C,F,G,H,I,J,
K,L
2O010.77
PQNPHYLLOQUINONEA,B,C,F,K,L2PPS0.77
PQNPHYLLOQUINONEA,B,C,F,K,L1C510.77
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
1QZV0.77
HY1PHENYLACETALDEHYDED,H2I0S0.8
HY1PHENYLACETALDEHYDEA,B1D6Y0.8
HY1PHENYLACETALDEHYDEA,B1D6Z0.8
HY1PHENYLACETALDEHYDED,H2OK40.8
HY1PHENYLACETALDEHYDEA,B1D6U0.8
DMW2,3-DIMETHYL-1,4-NAPHTHOQUINONEA,B,C,D,E,F2BS40.81
3PL3-PHENYLPROPANALE1Y3G0.78
NLANAPHTHALEN-1-YL-ACETIC ACIDA,B,C,D1LRH0.73
NLANAPHTHALEN-1-YL-ACETIC ACIDB2P1O0.73
BFLA,B1Q4G0.7
1LPTRANYLCYPROMINEA,B1OJB0.78
C0E3-fluoro-6-(4-fluorophenyl)-2-hydroxy-
6-oxohexa-2,4-dienoic acid
A2RHW0.72
HPK(3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATEA2PUH0.73
LEG1-(4-HEXYLPHENYL)PROP-2-EN-1-ONEA,B2PIN0.77
ANQACENAPHTHENEQUINONEH,J1OAX0.77
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.7
DFADIPHENYLACETIC ACIDA,B,C1GMY0.72
9TA1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)-
ETHYLAMINO]-ANTHRAQUINONE
A,B1FDG0.83
AN3ANTHRACENEA,B2HMN0.7
AN3ANTHRACENEA,B2HMM0.7
HCIHYDROCINNAMIC ACIDA,B1BXG0.71
HCIHYDROCINNAMIC ACIDA,B1TOG0.71
HCIHYDROCINNAMIC ACIDA,B1V2F0.71
HCIHYDROCINNAMIC ACIDA,B1AHX0.71
HCIHYDROCINNAMIC ACIDA1TOI0.71
HCIHYDROCINNAMIC ACIDA,B1AY80.71
HCIHYDROCINNAMIC ACIDA1TOJ0.71
PHMPHENYLALANYLMETHANEA,I1PJP0.7
PHMPHENYLALANYLMETHANEA,B,C2J9J0.7
PHMPHENYLALANYLMETHANEA,B,C2JE40.7
AC01-PHENYLETHANONEA1ZK10.8
AC01-PHENYLETHANONEA1ZK40.8
BDBA,B1KE30.71
NPYNAPHTHALENEA,B1O7G0.76
HZH1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan-
2-one
A,B3DEA0.73
KPV5-PHENYL-2-KETO-VALERIC ACIDA,B2Q5Q0.71
PEYPHENANTHRENEA,B2HML0.7
PEYPHENANTHRENEA,B2HMK0.7