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: MMs03201327

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SHU4,6-DIOXOHEPTANOIC ACIDA1H7R0.71
DSB4,7-DIOXOSEBACIC ACIDA,B1I8J0.71
DSB4,7-DIOXOSEBACIC ACIDA1EB30.71
DSB4,7-DIOXOSEBACIC ACIDA,B1L6S0.71
DSB4,7-DIOXOSEBACIC ACIDA,B2C1H0.71
DHD2,4-DIOXO-PENTANEDIOIC ACIDA,B,C,D1CS10.76
AKG2-OXYGLUTARIC ACIDA,B,C,D1YBA0.78
AKG2-OXYGLUTARIC ACIDA1DS10.78
AKG2-OXYGLUTARIC ACIDA1H2L0.78
AKG2-OXYGLUTARIC ACIDA,B,C1NX80.78
AKG2-OXYGLUTARIC ACIDA,B3BUC0.78
AKG2-OXYGLUTARIC ACIDA2RDN0.78
AKG2-OXYGLUTARIC ACIDA,B3BIE0.78
AKG2-OXYGLUTARIC ACIDA,D1OIK0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D3DC10.78
AKG2-OXYGLUTARIC ACIDA,B2FDF0.78
AKG2-OXYGLUTARIC ACIDA3D8C0.78
AKG2-OXYGLUTARIC ACIDA1DRY0.78
AKG2-OXYGLUTARIC ACIDA,B2FDH0.78
AKG2-OXYGLUTARIC ACIDA,B,C2J9E0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F2QFY0.78
AKG2-OXYGLUTARIC ACIDA1UNB0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D1OIJ0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F2QFX0.78
AKG2-OXYGLUTARIC ACIDA,B1GQW0.78
AKG2-OXYGLUTARIC ACIDA,B3BKZ0.78
AKG2-OXYGLUTARIC ACIDA,B2GP50.78
AKG2-OXYGLUTARIC ACIDA,B3GJB0.78
AKG2-OXYGLUTARIC ACIDA1GP40.78
AKG2-OXYGLUTARIC ACIDA2RDQ0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F1HWY0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
2VDC0.78
AKG2-OXYGLUTARIC ACIDA,B3BU00.78
AKG2-OXYGLUTARIC ACIDA,B2FCT0.78
AKG2-OXYGLUTARIC ACIDA,B,F,G2Q8C0.78
AKG2-OXYGLUTARIC ACIDA,B1GY90.78
AKG2-OXYGLUTARIC ACIDA,B,C,D1OII0.78
AKG2-OXYGLUTARIC ACIDA2A1X0.78
AKG2-OXYGLUTARIC ACIDA1H2N0.78
AKG2-OXYGLUTARIC ACIDA,B,C1NX40.78
AKG2-OXYGLUTARIC ACIDA2BRT0.78
AKG2-OXYGLUTARIC ACIDA,B2FCV0.78
AKG2-OXYGLUTARIC ACIDA,B2FDI0.78
AKG2-OXYGLUTARIC ACIDA2YU10.78
AKG2-OXYGLUTARIC ACIDA,B2FDK0.78
AKG2-OXYGLUTARIC ACIDA1E5I0.78
AKG2-OXYGLUTARIC ACIDA1UOB0.78
AKG2-OXYGLUTARIC ACIDA,B1OFE0.78
AKG2-OXYGLUTARIC ACIDA2ILM0.78
AKG2-OXYGLUTARIC ACIDA,B2FCU0.78
AKG2-OXYGLUTARIC ACIDA,B1AIB0.78
AKG2-OXYGLUTARIC ACIDA1RXG0.78
AKG2-OXYGLUTARIC ACIDA1MZF0.78
AKG2-OXYGLUTARIC ACIDA,B1EA00.78
AKG2-OXYGLUTARIC ACIDA1DRT0.78
AKG2-OXYGLUTARIC ACIDA2IUW0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D3BN10.78
AKG2-OXYGLUTARIC ACIDA,B2FD80.78
AKG2-OXYGLUTARIC ACIDA2JJH0.78
AKG2-OXYGLUTARIC ACIDA1IKA0.78
AKG2-OXYGLUTARIC ACIDA,B,C,D1OS70.78
AKG2-OXYGLUTARIC ACIDA1MDX0.78
AKG2-OXYGLUTARIC ACIDA,B1OFD0.78
AKG2-OXYGLUTARIC ACIDA2CJH0.78
AKG2-OXYGLUTARIC ACIDA1GP50.78
AKG2-OXYGLUTARIC ACIDA1CW40.78
AKG2-OXYGLUTARIC ACIDA,B3BI30.78
AKG2-OXYGLUTARIC ACIDA1BL50.78
AKG2-OXYGLUTARIC ACIDA1LLW0.78
AKG2-OXYGLUTARIC ACIDA2ZE30.78
AKG2-OXYGLUTARIC ACIDA1GVG0.78
SHFLAEVULINIC ACIDA1YLV0.88
SHFLAEVULINIC ACIDA1H7N0.88
HKV4,5-DIOXOPENTANOIC ACIDA2JB80.76
DO42,5-DIOXOPENTANOIC ACIDX2Q1D0.7
2KT2-KETOBUTYRIC ACIDA1RR20.71
2KT2-KETOBUTYRIC ACIDA,B,C2UYN0.71
2KT2-KETOBUTYRIC ACIDA,B,C,D1TZK0.71
2KT2-KETOBUTYRIC ACIDX2Q1C0.71
2KT2-KETOBUTYRIC ACIDX2Q1A0.71
LEALEVULINIC ACIDP1VWR0.76
LEALEVULINIC ACIDM,P1VWJ0.76
LEALEVULINIC ACIDA,B1W1Z0.76
LEALEVULINIC ACIDA,B1B4K0.76
LEALEVULINIC ACIDM,P1VWK0.76
LEALEVULINIC ACIDP1VWQ0.76
LEALEVULINIC ACIDA1UK80.76
LEALEVULINIC ACIDM,P1VWL0.76
LEALEVULINIC ACIDM,P1VWI0.76
LEALEVULINIC ACIDA1B4E0.76
LAF5-FLUOROLEVULINIC ACIDA,B1GZG1
SINSUCCINIC ACIDA,B1KQE0.73
SINSUCCINIC ACIDA,B,C,D1KOR0.73
SINSUCCINIC ACIDA,B,C,D3GXW0.73
SINSUCCINIC ACIDA2AYD0.73
SINSUCCINIC ACIDA,B,D,E2BWN0.73
SINSUCCINIC ACIDA,B3E4O0.73
SINSUCCINIC ACIDC,D1ZKF0.73
SINSUCCINIC ACIDA1UO90.73
SINSUCCINIC ACIDA,B3BY90.73
SINSUCCINIC ACIDH,I1OYT0.73
SINSUCCINIC ACIDA,B,C,D1VZ50.73
SINSUCCINIC ACIDI1THS0.73
SINSUCCINIC ACIDA2WBP0.73
SINSUCCINIC ACIDA,B2DJL0.73
SINSUCCINIC ACIDD,H2FES0.73
SINSUCCINIC ACIDA,B3CQY0.73
SINSUCCINIC ACIDA,B,F,G2Q8D0.73
SINSUCCINIC ACIDA,B2BIF0.73
SINSUCCINIC ACIDA2FDJ0.73
SINSUCCINIC ACIDA1O6F0.73
SINSUCCINIC ACIDA1O6G0.73
SINSUCCINIC ACIDH2CN00.73
SINSUCCINIC ACIDC,D1RMH0.73
SINSUCCINIC ACIDA,B,D,F,G,H,I2IXP0.73
SINSUCCINIC ACIDA,B3EDN0.73
SINSUCCINIC ACIDA2CNQ0.73
SINSUCCINIC ACIDA,B,C,D2Z0A0.73
SINSUCCINIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1HQJ0.73
SINSUCCINIC ACIDA3GC20.73
SINSUCCINIC ACIDS1AU80.73
SINSUCCINIC ACIDA1RPV0.73
SINSUCCINIC ACIDB,M,P2RKZ0.73
SINSUCCINIC ACIDA1KYC0.73
SINSUCCINIC ACIDA1D4D0.73
SINSUCCINIC ACIDB1PIP0.73
SINSUCCINIC ACIDD,H2FEQ0.73
SINSUCCINIC ACIDH,P2ANK0.73
SINSUCCINIC ACIDA1CZE0.73
SINSUCCINIC ACIDA,B,C,D,E,F,
G,H
3HWK0.73
SINSUCCINIC ACIDA,B,C,D1F8I0.73
SINSUCCINIC ACIDA,B,C,D1XG30.73
SINSUCCINIC ACIDH,P2A2X0.73
SINSUCCINIC ACIDA1H2Z0.73
SINSUCCINIC ACIDA,B,C,D1HG00.73
SINSUCCINIC ACIDA,B,C,D,E,F,
G,H
1L4X0.73
SINSUCCINIC ACIDA2CSG0.73
SINSUCCINIC ACIDA1KNP0.73
SINSUCCINIC ACIDA1E5H0.73
SINSUCCINIC ACIDA1ABZ0.73
SINSUCCINIC ACIDD,H1NZQ0.73
SINSUCCINIC ACIDA,B2V620.73
SINSUCCINIC ACIDA,B2FDG0.73
SINSUCCINIC ACIDA,B2FDK0.73
SINSUCCINIC ACIDA,B2FDI0.73
SINSUCCINIC ACIDH2CF90.73
SINSUCCINIC ACIDB1LOP0.73
SINSUCCINIC ACIDA,B1H6C0.73
SINSUCCINIC ACIDA3BIF0.73
SINSUCCINIC ACIDA1ZWG0.73
SINSUCCINIC ACIDS1CGH0.73
SINSUCCINIC ACIDD,H1O0D0.73
SINSUCCINIC ACIDH2CF80.73
SINSUCCINIC ACIDA2CGN0.73
SINSUCCINIC ACIDA,X2AGE0.73
SINSUCCINIC ACIDA,B,C,D,E,F,
G,H
3HZN0.73
SINSUCCINIC ACIDA,B1QGL0.73
SINSUCCINIC ACIDH2V3O0.73
SINSUCCINIC ACIDA,B,C,D2PC60.73
SINSUCCINIC ACIDA2R2J0.73
SINSUCCINIC ACIDH,I2V3H0.73
SINSUCCINIC ACIDC1V9T0.73
SINSUCCINIC ACIDA2OG70.73
SINSUCCINIC ACIDA,D1VZ40.73
SINSUCCINIC ACIDA,X2AGG0.73
SINSUCCINIC ACIDA1GP60.73