MMsINC Database Search
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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02904000

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PDCPYRIDINE-2,6-DICARBOXYLIC ACIDA2PC20.83
PDCPYRIDINE-2,6-DICARBOXYLIC ACIDA,B,C,D1ARZ0.83
PDCPYRIDINE-2,6-DICARBOXYLIC ACIDA2PE70.83
PDCPYRIDINE-2,6-DICARBOXYLIC ACIDA2PES0.83
PDCPYRIDINE-2,6-DICARBOXYLIC ACIDA,B1C3V0.83
PDCPYRIDINE-2,6-DICARBOXYLIC ACIDA,B1P9L0.83
FIC5-fluoroindole-2-carboxylic acidA,B3DWS0.78
VX32,3-diphenyl-1H-indole-7-carboxylic acidA3BGZ0.74
QUA8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE-
2-CARBOXYLIC ACID		C2JQ70.86
QUA8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE-
2-CARBOXYLIC ACID		B1OLN0.86
QUA8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE-
2-CARBOXYLIC ACID		A1E9W0.86
238A2PRH0.81
I4A5-(3-carbamoylbenzyl)-5,6,7,8,9,10-
hexahydrocyclohepta[b]indole-4-
carboxylic acid		A3FR50.73
LG26-[1-(3,5,5,8,8-PENTAMETHYL-5,6,7,8-
TETRAHYDRONAPHTHALEN-2-YL)CYCLOPROPYL]PYRIDINE-
3-CARBOXYLIC ACID		A,B,C,D1H9U0.72
6PCPYRIDINE-2-CARBOXYLIC ACIDA2OLN0.75
6PCPYRIDINE-2-CARBOXYLIC ACIDA2OLO0.75
IDA(2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO-
INDOL-7-YL)ACETIC ACID		A,B1OXL0.71
NHR2-{4-[2-(2-AMINO-4-HYDROXY-QUINAZOLIN-
6-YL)-1-CARBOXY-ETHYL]-BENZOYLAMINO}-
PENTANEDIOIC ACID		A,B1C3E0.72
NPV4-[8-(3-nitrophenyl)-1,7-naphthyridin-
6-yl]benzoic acid		A,B2QYN0.76
NPV4-[8-(3-nitrophenyl)-1,7-naphthyridin-
6-yl]benzoic acid		A,B2QYK0.76
NPV4-[8-(3-nitrophenyl)-1,7-naphthyridin-
6-yl]benzoic acid		A2QYL0.76
HQU3-HYDROXYQUINALDIC ACIDC,D193D0.86
PMC3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1I430.77
BRFA1UUO0.86
9AC9-ACRIDINECARBONYLA,B,G,J,K,L,M1G3X0.76
POO3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN-
3-YL)METHYL]AMINO}-2-OXOETHYL)-
2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID		A2BRL0.74
QNDQUINALDIC ACIDA,B1IDA0.94
DPYA,B1JES0.76
ICO1H-INDOLE-3-CARBOXYLIC ACIDL2PIP0.72
4HGN-[(4-HYDROXY-8-IODOISOQUINOLIN-
3-YL)CARBONYL]GLYCINE		A2G190.72
4HGN-[(4-HYDROXY-8-IODOISOQUINOLIN-
3-YL)CARBONYL]GLYCINE		A2G1M0.72
F8A9-[2-(trifluoromethyl)benzyl]-2,3,4,9-
tetrahydro-1H-carbazole-8-carboxylic acid		A3FR40.72
CLI3-(2-CARBOXY-ETHYL)-4,6-DICHLORO-
1H-INDOLE-2-CARBOXYLIC ACID		A,F1LEV0.74
QNC2-CARBONYLQUINOLINEA,B1MTB0.77
QNC2-CARBONYLQUINOLINEA,B2FGV0.77
QNC2-CARBONYLQUINOLINEI1IVQ0.77
QNC2-CARBONYLQUINOLINEA,B2FGU0.77
QNC2-CARBONYLQUINOLINEA1JLD0.77
QNC2-CARBONYLQUINOLINEA,B1HXB0.77
1167-[4-(4-FLUORO-PHENYL)-5-HYDROXYMETHYL-
2,6-DIISOPROPYL-PYRIDIN-3-YL]-3,5-
DIHYDROXY-HEPTANOIC ACID		A,B,C,D1HWJ0.71
TRO2-HYDROXY-TRYPTOPHANA1KB00.72
TRO2-HYDROXY-TRYPTOPHANA1G3P0.72
NTMQUINOLINIC ACIDA3C2O0.75
NTMQUINOLINIC ACIDA,B1QAP0.75
NTMQUINOLINIC ACIDA,B,C,D,E,F1QPQ0.75
NTMQUINOLINIC ACIDA,B,C2B7N0.75
PYA3-(1,10-PHENANTHROL-2-YL)-L-ALANINEA1HCW0.73
PQQPYRROLOQUINOLINE QUINONEA,B1CQ10.8
PQQPYRROLOQUINOLINE QUINONEA,B1OTW0.8
PQQPYRROLOQUINOLINE QUINONEA,B1C9U0.8
PQQPYRROLOQUINOLINE QUINONEA,C1W6S0.8
PQQPYRROLOQUINOLINE QUINONEA,B1FLG0.8
PQQPYRROLOQUINOLINE QUINONEA1KV90.8
PQQPYRROLOQUINOLINE QUINONEA,C2AD60.8
PQQPYRROLOQUINOLINE QUINONEA,B1CRU0.8
PQQPYRROLOQUINOLINE QUINONEA,C1H4I0.8
PQQPYRROLOQUINOLINE QUINONEA,C2AD70.8
PQQPYRROLOQUINOLINE QUINONEA,C2AD80.8
PQQPYRROLOQUINOLINE QUINONEA,D,I2D0V0.8
PQQPYRROLOQUINOLINE QUINONEA,C4AAH0.8
PQQPYRROLOQUINOLINE QUINONEA,C,E,G1H4J0.8
PQQPYRROLOQUINOLINE QUINONEA1KB00.8
PQQPYRROLOQUINOLINE QUINONEA1YIQ0.8
PQQPYRROLOQUINOLINE QUINONEA,C1LRW0.8
PQQPYRROLOQUINOLINE QUINONEA,C1G720.8
CRR3,4-DI-1H-INDOL-3-YL-1H-PYRROLE-
2,5-DICARBOXYLIC ACID		A2Z3U0.72
TCRCYCLOMETHYLTRYPTOPHANA3AIG0.71
CMF3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL-
2-OXOETHYL)-2-PHENYL-1H-INDOLE-
6-CARBOXYLIC ACID		A2BRK0.75
HQA3-(8-hydroxyquinolin-3-yl)-L-alanineA,B3FCA0.74
DK15,7-DICHLORO-4-HYDROXYQUINOLINE-
2-CARBOXYLIC ACID		A,B1PBQ0.79
1IQ2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5-
DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE-
3-CARBOXYLIC ACID		A1Z8N0.77
QNO2-NONYL-4-HYDROXYQUINOLINE N-OXIDEC,D,E1NU10.74
QNO2-NONYL-4-HYDROXYQUINOLINE N-OXIDEA,B,C,D,G2E750.74
BRE2-BIPHENYL-4-YL-6-FLUORO-3-METHYL-
QUINOLINE-4-CARBOXYLIC ACID		A1D3G0.86
BIN2,3-DICARBOXY-4-(2-CHLORO-PHENYL)-
1-ETHYL-5-ISOPROPOXYCARBONYL-6-
METHYL-PYRIDINIUM		A1C8L0.72
BIN2,3-DICARBOXY-4-(2-CHLORO-PHENYL)-
1-ETHYL-5-ISOPROPOXYCARBONYL-6-
METHYL-PYRIDINIUM		A2AMV0.72
BIN2,3-DICARBOXY-4-(2-CHLORO-PHENYL)-
1-ETHYL-5-ISOPROPOXYCARBONYL-6-
METHYL-PYRIDINIUM		A3AMV0.72
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA,B,C2W2I0.82
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA2GKL0.82
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA,B2VD70.82
PD2PYRIDINE-2,4-DICARBOXYLIC ACIDA,B2JIG0.82
BMSA,B1DKF0.71
HQO2-HEPTYL-4-HYDROXY QUINOLINE N-
OXIDE		A,B,C1KQG0.74
HQO2-HEPTYL-4-HYDROXY QUINOLINE N-
OXIDE		A,B,C,D,E,F2VR00.74
HQO2-HEPTYL-4-HYDROXY QUINOLINE N-
OXIDE		A,B,C,M,N,O,P1KF60.74
UN9N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-
3-YL)CARBONYL]GLYCINE		A2HBT0.74
UN9N-[(1-CHLORO-4-HYDROXYISOQUINOLIN-
3-YL)CARBONYL]GLYCINE		A2HBU0.74
8CA9-benzyl-2,3,4,9-tetrahydro-1H-
carbazole-8-carboxylic acid		A3FR20.74
7722-CYANOQUINOLIN-8-YL DIHYDROGEN PHOSPHATEA1O4H0.71