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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00008840

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ALYN(6)-ACETYLLYSINEA,B2B4D0.71
ALYN(6)-ACETYLLYSINEA,B2OD90.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.71
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.71
ALYN(6)-ACETYLLYSINEA,B2B5G0.71
ALYN(6)-ACETYLLYSINEA2GIV0.71
ALYN(6)-ACETYLLYSINEB2RNY0.71
ALYN(6)-ACETYLLYSINEA1JSP0.71
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.71
ALYN(6)-ACETYLLYSINEA,D3D4B0.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.71
ALYN(6)-ACETYLLYSINEA,B2R0Y0.71
ALYN(6)-ACETYLLYSINEA3CZ70.71
ALYN(6)-ACETYLLYSINEA1JM40.71
ALYN(6)-ACETYLLYSINEA,B2H4H0.71
ALYN(6)-ACETYLLYSINEA,B2J6V0.71
ALYN(6)-ACETYLLYSINEA,B2R100.71
ALYN(6)-ACETYLLYSINEA,B1YC50.71
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.71
ALYN(6)-ACETYLLYSINEA,B2H2G0.71
ALYN(6)-ACETYLLYSINEA,D2H4F0.71
ALYN(6)-ACETYLLYSINEA2OU20.71
ALYN(6)-ACETYLLYSINEA,B1S5P0.71
ALYN(6)-ACETYLLYSINEB2RNW0.71
ALYN(6)-ACETYLLYSINEA3D350.71
ALYN(6)-ACETYLLYSINEA,B2OD20.71
ALYN(6)-ACETYLLYSINEA2ZFN0.71
ALYN(6)-ACETYLLYSINEC,D2C1J0.71
ALYN(6)-ACETYLLYSINEA,B2QQG0.71
ALYN(6)-ACETYLLYSINEB2RNX0.71
ALYN(6)-ACETYLLYSINEA,B1MA30.71
ALYN(6)-ACETYLLYSINEA,B2H2H0.71
ALYN(6)-ACETYLLYSINEA2I2Z0.71
ALYN(6)-ACETYLLYSINEA,B2OD70.71
ALYN(6)-ACETYLLYSINEP1E6I0.71
ALYN(6)-ACETYLLYSINEA,B1SZC0.71
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.71
ALYN(6)-ACETYLLYSINEA,B2H2D0.71
ALYN(6)-ACETYLLYSINEA,B1Q1A0.71
ALYN(6)-ACETYLLYSINEA,B1SZD0.71
ALYN(6)-ACETYLLYSINEQ,R2E3K0.71
ALYN(6)-ACETYLLYSINEA2OZU0.71
ALYN(6)-ACETYLLYSINEA,B2QQF0.71
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.71
AB52(S)-AMINO-6-BORONOHEXANOIC ACIDA,B2AEB0.7
AROC-GAMMA-HYDROXY ARGININEA,B,C,D,E,F1FFV0.73
AROC-GAMMA-HYDROXY ARGININEA,B,C,D,E,F1FFU0.73
1PI3-(1-CARBAMIMIDOYL-PIPERIDIN-3-
YL)-L-ALANINE
A,B1ZZZ0.72
2MRN3, N4-DIMETHYLARGININEA,B,D,E2V870.78
2MRN3, N4-DIMETHYLARGININEA,B,D,F2V880.78
2MRN3, N4-DIMETHYLARGININEA1G4H0.78
2MRN3, N4-DIMETHYLARGININEA1G420.78
2MRN3, N4-DIMETHYLARGININEA1G5F0.78
DA2NG,NG-DIMETHYL-L-ARGININEA,C,P,R2VPG0.8
DA2NG,NG-DIMETHYL-L-ARGININEA,B7NSE0.8
DA2NG,NG-DIMETHYL-L-ARGININEA,B,D,E2V860.8
DA2NG,NG-DIMETHYL-L-ARGININED2B2U0.8
ARV5-N-ALLYL-ARGININEA,B1K2S0.74
AS1ARGININOSUCCINATEA,B,C,D1TJW0.74
AS1ARGININOSUCCINATED1DCN0.74
AS1ARGININOSUCCINATEA,B,C,D1K7W0.74
AS1ARGININOSUCCINATEA,B,C,D1J200.74
CIRCITRULLINEA,B,C,D1J210.71
CIRCITRULLINEB1KOD0.71
CIRCITRULLINEA,B,C3B3I0.71
CIRCITRULLINEC3DTX0.71
CIRCITRULLINEA2C6Z0.71
CIRCITRULLINEA,C,E,F2W650.71
CIRCITRULLINEA,B2JAI0.71
CIRCITRULLINEP3FT20.71
CIRCITRULLINEA,B,C,D1J1Z0.71
CIRCITRULLINEA,B1LXY0.71
CIRCITRULLINEF,H1OL10.71
CIRCITRULLINEA1KP30.71
CIRCITRULLINEA2NZ20.71
CIRCITRULLINEA1H700.71
CIRCITRULLINEA1K970.71
CIRCITRULLINEC3B6S0.71
D20N~5~-{IMINO[(2-METHOXYETHYL)AMINO]METHYL}-
L-ORNITHINE
A,B2JAJ0.76
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1BB00.72
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINE11YYY0.72
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1CA80.72
ARMDEOXY-METHYL-ARGININEB,C,E,F2A450.77
ARMDEOXY-METHYL-ARGININEH,J1CVW0.77
ARMDEOXY-METHYL-ARGININEA,H,L1J9C0.77
ARMDEOXY-METHYL-ARGININEA,B,I1Z8I0.77
ARMDEOXY-METHYL-ARGININEA1OLD0.77
ARMDEOXY-METHYL-ARGININEB,C,F,G2A1D0.77
ARMDEOXY-METHYL-ARGININEC,D,G,H1NU70.77
ARMDEOXY-METHYL-ARGININEB,C2OD30.77
ARMDEOXY-METHYL-ARGININEA,B,C,D,E,F,
G,H
1DX50.77
ARMDEOXY-METHYL-ARGININEB,C,E,F1NU90.77
ARMDEOXY-METHYL-ARGININEA2ARG0.77
ARMDEOXY-METHYL-ARGININEA,B,I1Z8J0.77
ARMDEOXY-METHYL-ARGININEA,B,C2PGQ0.77
DARD-ARGININEA,B2Q330.84
DARD-ARGININEA,B,E,F,G,H1MHW0.84
DARD-ARGININEA2JUE0.84
DARD-ARGININEH,I1A4W0.84
DARD-ARGININEA1BDK0.84
DARD-ARGININEA1CWZ0.84
DARD-ARGININEB1CFA0.84
DARD-ARGININEB,C3BV90.84
DARD-ARGININEA1CVQ0.84
DARD-ARGININEA1P520.84
DARD-ARGININEA,D1CZQ0.84
DARD-ARGININEA1CW80.84
DARD-ARGININEA,B,C,D3BOG0.84
DARD-ARGININEA1BFW0.84
DARD-ARGININEA1BG00.84
AARARGININEAMIDEA,B,I3DCK0.75
AARARGININEAMIDEA1DB60.75
AARARGININEAMIDEA1ZTO0.75
AARARGININEAMIDEA,B2IFR0.75
AARARGININEAMIDEA,B,C,D2IFW0.75
AARARGININEAMIDEA,B,I3DCR0.75
AARARGININEAMIDEA,I2O400.75
AHLN-HYDROXY-L-ARGININAMIDEA,B2IMB0.7
AHLN-HYDROXY-L-ARGININAMIDEA,B2G7Q0.7
3ARN-OMEGA-PROPYL-L-ARGININEA1QW60.82
3ARN-OMEGA-PROPYL-L-ARGININEA,B1QW40.82
3ARN-OMEGA-PROPYL-L-ARGININEA,B1MMV0.82
CSIAMINO-(2-IMINO-HEXAHYDRO-PYRIMIDIN-
4-YL)-ACETIC ACID
A,B1KE20.73
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBO0.86
AGM5-METHYL-ARGININEA,C,D,F1MRO0.86
AGM5-METHYL-ARGININEA,C,D,F1E6Y0.86
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBM0.86
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBN0.86
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBU0.86
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.75
CMAN2-(CARBOXYETHYL)-L-ARGININEA,B1JGT0.77