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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02487677

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2NCN-{(2S)-2-[(N-acetyl-L-threonyl-
L-isoleucyl)amino]hexyl}-L-norleucyl-
L-glutaminyl-L-argininamide
A,B3BVA0.74
NMM(R)-2-AMINO-5-(3-METHYLGUANIDINO)BUTANOIC ACIDA,B,D,E2V850.77
ZRGN~2~-acetyl-N-methyl-N~5~-[N-(methylcarbamoyl)carbamimidoyl]-
L-ornithinamide
A,B3CHC0.77
BG45-(HYDROXY-METHYL-AMINO)-3-METHYL-
PYRROLIDINE-2-CARBOXYLIC ACID
A1TV30.72
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.73
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1BB00.73
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINE11YYY0.73
3GA3-PIPERIDYL-N-GUANIDINO-L-ALANINEB,C1CA80.73
SVCN-ACETYL-L-LEUCYL-N-[(1S)-4-{[AMINO(IMINO)METHYL]AMINO}-
1-(HYDROXYMETHYL)BUTYL]-L-LEUCINAMIDE
A,B3BPM0.83
1PI3-(1-CARBAMIMIDOYL-PIPERIDIN-3-
YL)-L-ALANINE
A,B1ZZZ0.73
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D2GGH0.71
NLQN~2~-ACETYL-L-GLUTAMINEA,B,C,D1XPY0.71
AS1ARGININOSUCCINATEA,B,C,D1TJW0.74
AS1ARGININOSUCCINATED1DCN0.74
AS1ARGININOSUCCINATEA,B,C,D1K7W0.74
AS1ARGININOSUCCINATEA,B,C,D1J200.74
VION5-(1-IMINO-3-BUTENYL)-L-ORNITHINEA,B1MMW0.73
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A2BJS0.75
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1QJE0.75
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BK00.75
ACVL-D-(A-AMINOADIPOYL)-L-CYSTEINYL-
D-VALINE
A1BLZ0.75
BG55-HYDROXYAMINO-3-METHYL-PYRROLIDINE-
2-CARBOXYLIC ACID
A1TV20.73
ORQN~5~-ACETYL-L-ORNITHINEP,Q2FX90.72
D20N~5~-{IMINO[(2-METHOXYETHYL)AMINO]METHYL}-
L-ORNITHINE
A,B2JAJ0.76
IMLN-METHYL-ISOLEUCINEC1CWM0.71
MGG2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-
PENTANOIC ACID
A1CVQ0.81
PYHN~6~-{[(2R,3R)-3-METHYL-3,4-DIHYDRO-
2H-PYRROL-2-YL]CARBONYL}-L-LYSINE
A2ZCE0.73
M3RMethyl phosphonated L-ArginineA3GNH0.71
2MRN3, N4-DIMETHYLARGININEA,B,D,E2V870.75
2MRN3, N4-DIMETHYLARGININEA,B,D,F2V880.75
2MRN3, N4-DIMETHYLARGININEA1G4H0.75
2MRN3, N4-DIMETHYLARGININEA1G420.75
2MRN3, N4-DIMETHYLARGININEA1G5F0.75
CMAN2-(CARBOXYETHYL)-L-ARGININEA,B1JGT0.79
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.7
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.71
IELN~6~-[(1Z)-ethanimidoyl]-L-lysineA3DIR0.72
DARD-ARGININEA,B2Q330.76
DARD-ARGININEA,B,E,F,G,H1MHW0.76
DARD-ARGININEA2JUE0.76
DARD-ARGININEH,I1A4W0.76
DARD-ARGININEA1BDK0.76
DARD-ARGININEA1CWZ0.76
DARD-ARGININEB1CFA0.76
DARD-ARGININEB,C3BV90.76
DARD-ARGININEA1CVQ0.76
DARD-ARGININEA1P520.76
DARD-ARGININEA,D1CZQ0.76
DARD-ARGININEA1CW80.76
DARD-ARGININEA,B,C,D3BOG0.76
DARD-ARGININEA1BFW0.76
DARD-ARGININEA1BG00.76
IGN{[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)-
1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID
A1K1O0.76
IGN{[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)-
1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID
H,I1K210.76
HMRBETA-HOMOARGININEI1ABI0.7
HMRBETA-HOMOARGININER1NRQ0.7
HMRBETA-HOMOARGININER1NRP0.7
HMRBETA-HOMOARGININEA3C3G0.7
HMRBETA-HOMOARGININEA3C3H0.7
U0EN-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-
2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-
CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE
B1GNO0.7
U0EN-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-
2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-
CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE
B1A9M0.7
U0EN-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-
2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-
CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE
A1AXA0.7
U0EN-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-
2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-
CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE
A1GNM0.7
U0EN-[[1-[N-ACETAMIDYL]-[1-CYCLOHEXYLMETHYL-
2-HYDROXY-4-ISOPROPYL]-BUT-4-YL]-
CARBONYL]-GLUTAMINYL-ARGINYL-AMIDE
A1GNN0.7
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.71
HRGL-HOMOARGININEA,B,C2VDN0.75
HRGL-HOMOARGININEA3DIQ0.75
HRGL-HOMOARGININEA,B1DM70.75
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.79
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.74
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.72
X7O5-AMINO-3-METHYL-PYRROLIDINE-2-
CARBOXYLIC ACID
A1L2Q0.76
ILON5-IMINOETHYL-L-ORNITHINEA,B1ED60.71
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBO0.73
AGM5-METHYL-ARGININEA,C,D,F1MRO0.73
AGM5-METHYL-ARGININEA,C,D,F1E6Y0.73
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBM0.73
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBN0.73
AGM5-METHYL-ARGININEA,B,C,D,E,F1HBU0.73
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
CSIAMINO-(2-IMINO-HEXAHYDRO-PYRIMIDIN-
4-YL)-ACETIC ACID
A,B1KE20.72
I584R-FLUORO-N6-ETHANIMIDOYL-L-LYSINEA,B1R350.7
ALYN(6)-ACETYLLYSINEA,B2B4D0.72
ALYN(6)-ACETYLLYSINEA,B2OD90.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.72
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.72
ALYN(6)-ACETYLLYSINEA,B2B5G0.72
ALYN(6)-ACETYLLYSINEA2GIV0.72
ALYN(6)-ACETYLLYSINEB2RNY0.72
ALYN(6)-ACETYLLYSINEA1JSP0.72
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.72
ALYN(6)-ACETYLLYSINEA,D3D4B0.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.72
ALYN(6)-ACETYLLYSINEA,B2R0Y0.72
ALYN(6)-ACETYLLYSINEA3CZ70.72
ALYN(6)-ACETYLLYSINEA1JM40.72
ALYN(6)-ACETYLLYSINEA,B2H4H0.72
ALYN(6)-ACETYLLYSINEA,B2J6V0.72
ALYN(6)-ACETYLLYSINEA,B2R100.72
ALYN(6)-ACETYLLYSINEA,B1YC50.72
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.72
ALYN(6)-ACETYLLYSINEA,B2H2G0.72
ALYN(6)-ACETYLLYSINEA,D2H4F0.72
ALYN(6)-ACETYLLYSINEA2OU20.72
ALYN(6)-ACETYLLYSINEA,B1S5P0.72
ALYN(6)-ACETYLLYSINEB2RNW0.72
ALYN(6)-ACETYLLYSINEA3D350.72
ALYN(6)-ACETYLLYSINEA,B2OD20.72
ALYN(6)-ACETYLLYSINEA2ZFN0.72
ALYN(6)-ACETYLLYSINEC,D2C1J0.72
ALYN(6)-ACETYLLYSINEA,B2QQG0.72
ALYN(6)-ACETYLLYSINEB2RNX0.72
ALYN(6)-ACETYLLYSINEA,B1MA30.72
ALYN(6)-ACETYLLYSINEA,B2H2H0.72
ALYN(6)-ACETYLLYSINEA2I2Z0.72
ALYN(6)-ACETYLLYSINEA,B2OD70.72
ALYN(6)-ACETYLLYSINEP1E6I0.72
ALYN(6)-ACETYLLYSINEA,B1SZC0.72
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.72
ALYN(6)-ACETYLLYSINEA,B2H2D0.72
ALYN(6)-ACETYLLYSINEA,B1Q1A0.72
ALYN(6)-ACETYLLYSINEA,B1SZD0.72
ALYN(6)-ACETYLLYSINEQ,R2E3K0.72
ALYN(6)-ACETYLLYSINEA2OZU0.72
ALYN(6)-ACETYLLYSINEA,B2QQF0.72
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.72
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1AEC0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B2PRE0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1CV80.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A3C9E0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B3BCN0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1ATK0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B,C,D3BPF0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1TLO0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1QX60.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1MEG0.78
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B,C,D2BDZ0.78
HARN-OMEGA-HYDROXY-L-ARGININEX2FBZ0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWW0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B3NOS0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWV0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWX0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B5NSE0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B2FC20.74
HARN-OMEGA-HYDROXY-L-ARGININEA1M7Z0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B,C1HQF0.74
HARN-OMEGA-HYDROXY-L-ARGININEA,B1LZX0.74
GND2-AMINO-5-GUANIDINO-PENTANOIC ACIDA1NBK0.76
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.71
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.75
SJ1N-(ISOBUTOXYCARBONYL)-D-SERYL-N-
((1S)-4-{[AMINO(IMINO)METHYL]AMINO}-
1-FORMYLBUTYL)-L-ALANINAMIDE
U1W100.78
MMON~5~-(DIAMINOMETHYLENE)-N~2~-METHYLORNITHINEA1EB10.73
1691-(4-TERT-BUTYLCARBAMOYL-PIPERAZINE-
1-CARBONYL)-3-(3-GUANIDINO-PROPYL)-
4-OXO-AZETIDINE-2-CARBOXYLIC ACID
A1RXP0.77
DA2NG,NG-DIMETHYL-L-ARGININEA,C,P,R2VPG0.78
DA2NG,NG-DIMETHYL-L-ARGININEA,B7NSE0.78
DA2NG,NG-DIMETHYL-L-ARGININEA,B,D,E2V860.78
DA2NG,NG-DIMETHYL-L-ARGININED2B2U0.78
3ARN-OMEGA-PROPYL-L-ARGININEA1QW60.79
3ARN-OMEGA-PROPYL-L-ARGININEA,B1QW40.79
3ARN-OMEGA-PROPYL-L-ARGININEA,B1MMV0.79
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.72
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.71
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.71
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.89
CDV3-METHYL-2-UREIDO-BUTYRIC ACIDB1UF70.74
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.82
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.82
AN0N-ACETYL-L-NORVALINEC,D,E,X,Y,Z2G7M0.72
AN0N-ACETYL-L-NORVALINEA1ZQ80.72
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.71
PCXDEOXYGUANIDINOPROCLAVAMINIC ACIDA1GVG0.82
PCXDEOXYGUANIDINOPROCLAVAMINIC ACIDA,B1MC10.82
CIRCITRULLINEA,B,C,D1J210.72
CIRCITRULLINEB1KOD0.72
CIRCITRULLINEA,B,C3B3I0.72
CIRCITRULLINEC3DTX0.72
CIRCITRULLINEA2C6Z0.72
CIRCITRULLINEA,C,E,F2W650.72
CIRCITRULLINEA,B2JAI0.72
CIRCITRULLINEP3FT20.72
CIRCITRULLINEA,B,C,D1J1Z0.72
CIRCITRULLINEA,B1LXY0.72
CIRCITRULLINEF,H1OL10.72
CIRCITRULLINEA1KP30.72
CIRCITRULLINEA2NZ20.72
CIRCITRULLINEA1H700.72
CIRCITRULLINEA1K970.72
CIRCITRULLINEC3B6S0.72
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.75