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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00484496

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.7
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.7
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.88
1PI3-(1-CARBAMIMIDOYL-PIPERIDIN-3-
YL)-L-ALANINE
A,B1ZZZ0.72
GND2-AMINO-5-GUANIDINO-PENTANOIC ACIDA1NBK0.74
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1BB00.72
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINE11YYY0.72
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1CA80.72
2MRN3, N4-DIMETHYLARGININEA,B,D,E2V870.74
2MRN3, N4-DIMETHYLARGININEA,B,D,F2V880.74
2MRN3, N4-DIMETHYLARGININEA1G4H0.74
2MRN3, N4-DIMETHYLARGININEA1G420.74
2MRN3, N4-DIMETHYLARGININEA1G5F0.74
AS1ARGININOSUCCINATEA,B,C,D1TJW0.73
AS1ARGININOSUCCINATED1DCN0.73
AS1ARGININOSUCCINATEA,B,C,D1K7W0.73
AS1ARGININOSUCCINATEA,B,C,D1J200.73
DA2NG,NG-DIMETHYL-L-ARGININEA,C,P,R2VPG0.76
DA2NG,NG-DIMETHYL-L-ARGININEA,B7NSE0.76
DA2NG,NG-DIMETHYL-L-ARGININEA,B,D,E2V860.76
DA2NG,NG-DIMETHYL-L-ARGININED2B2U0.76
DARD-ARGININEA,B2Q330.74
DARD-ARGININEA,B,E,F,G,H1MHW0.74
DARD-ARGININEA2JUE0.74
DARD-ARGININEH,I1A4W0.74
DARD-ARGININEA1BDK0.74
DARD-ARGININEA1CWZ0.74
DARD-ARGININEB1CFA0.74
DARD-ARGININEB,C3BV90.74
DARD-ARGININEA1CVQ0.74
DARD-ARGININEA1P520.74
DARD-ARGININEA,D1CZQ0.74
DARD-ARGININEA1CW80.74
DARD-ARGININEA,B,C,D3BOG0.74
DARD-ARGININEA1BFW0.74
DARD-ARGININEA1BG00.74
3ARN-OMEGA-PROPYL-L-ARGININEA1QW60.77
3ARN-OMEGA-PROPYL-L-ARGININEA,B1QW40.77
3ARN-OMEGA-PROPYL-L-ARGININEA,B1MMV0.77
CSIAMINO-(2-IMINO-HEXAHYDRO-PYRIMIDIN-
4-YL)-ACETIC ACID
A,B1KE20.7
HARN-OMEGA-HYDROXY-L-ARGININEX2FBZ0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWW0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B3NOS0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWV0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWX0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B5NSE0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B2FC20.72
HARN-OMEGA-HYDROXY-L-ARGININEA1M7Z0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B,C1HQF0.72
HARN-OMEGA-HYDROXY-L-ARGININEA,B1LZX0.72
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.72
D20N~5~-{IMINO[(2-METHOXYETHYL)AMINO]METHYL}-
L-ORNITHINE
A,B2JAJ0.75
CMAN2-(CARBOXYETHYL)-L-ARGININEA,B1JGT0.78
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBO0.72
AGM5-METHYL-ARGININEA,C,D,F1MRO0.72
AGM5-METHYL-ARGININEA,C,D,F1E6Y0.72
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBM0.72
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBN0.72
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBU0.72
CIRCITRULLINEA,B,C,D1J210.7
CIRCITRULLINEB1KOD0.7
CIRCITRULLINEA,B,C3B3I0.7
CIRCITRULLINEC3DTX0.7
CIRCITRULLINEA2C6Z0.7
CIRCITRULLINEA,C,E,F2W650.7
CIRCITRULLINEA,B2JAI0.7
CIRCITRULLINEP3FT20.7
CIRCITRULLINEA,B,C,D1J1Z0.7
CIRCITRULLINEA,B1LXY0.7
CIRCITRULLINEF,H1OL10.7
CIRCITRULLINEA1KP30.7
CIRCITRULLINEA2NZ20.7
CIRCITRULLINEA1H700.7
CIRCITRULLINEA1K970.7
CIRCITRULLINEC3B6S0.7
1691-(4-TERT-BUTYLCARBAMOYL-PIPERAZINE-
1-CARBONYL)-3-(3-GUANIDINO-PROPYL)-
4-OXO-AZETIDINE-2-CARBOXYLIC ACID
A1RXP0.72
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1AEC0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B2PRE0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1CV80.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A3C9E0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B3BCN0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1ATK0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B,C,D3BPF0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1TLO0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1QX60.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1MEG0.73
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B,C,D2BDZ0.73