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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00482895

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AROC-GAMMA-HYDROXY ARGININEA,B,C,D,E,F1FFV0.74
AROC-GAMMA-HYDROXY ARGININEA,B,C,D,E,F1FFU0.74
NSKN-SUCCINYL LYSINEA2P8B0.73
IGN{[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)-
1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID
A1K1O0.7
IGN{[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)-
1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID
H,I1K210.7
SUON~2~-(3-CARBOXYPROPANOYL)-L-ORNITHINEA,B,C,D1YNH0.76
GND2-AMINO-5-GUANIDINO-PENTANOIC ACIDA1NBK0.73
AORN~2~-ACETYL-L-ORNITHINEA1ZQ60.71
AS1ARGININOSUCCINATEA,B,C,D1TJW0.86
AS1ARGININOSUCCINATED1DCN0.86
AS1ARGININOSUCCINATEA,B,C,D1K7W0.86
AS1ARGININOSUCCINATEA,B,C,D1J200.86
3ARN-OMEGA-PROPYL-L-ARGININEA1QW60.74
3ARN-OMEGA-PROPYL-L-ARGININEA,B1QW40.74
3ARN-OMEGA-PROPYL-L-ARGININEA,B1MMV0.74
HARN-OMEGA-HYDROXY-L-ARGININEX2FBZ0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWW0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B3NOS0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWV0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B1DWX0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B5NSE0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B2FC20.71
HARN-OMEGA-HYDROXY-L-ARGININEA1M7Z0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B,C1HQF0.71
HARN-OMEGA-HYDROXY-L-ARGININEA,B1LZX0.71
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1AEC0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B2PRE0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1CV80.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A3C9E0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B3BCN0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1ATK0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B,C,D3BPF0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1TLO0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1QX60.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A1MEG0.76
E64N-[N-[1-HYDROXYCARBOXYETHYL-CARBONYL]LEUCYLAMINO-
BUTYL]-GUANIDINE
A,B,C,D2BDZ0.76
ZRGN~2~-acetyl-N-methyl-N~5~-[N-(methylcarbamoyl)carbamimidoyl]-
L-ornithinamide
A,B3CHC0.75
SJ1N-(ISOBUTOXYCARBONYL)-D-SERYL-N-
((1S)-4-{[AMINO(IMINO)METHYL]AMINO}-
1-FORMYLBUTYL)-L-ALANINAMIDE
U1W100.76
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.71
DARD-ARGININEA,B2Q330.73
DARD-ARGININEA,B,E,F,G,H1MHW0.73
DARD-ARGININEA2JUE0.73
DARD-ARGININEH,I1A4W0.73
DARD-ARGININEA1BDK0.73
DARD-ARGININEA1CWZ0.73
DARD-ARGININEB1CFA0.73
DARD-ARGININEB,C3BV90.73
DARD-ARGININEA1CVQ0.73
DARD-ARGININEA1P520.73
DARD-ARGININEA,D1CZQ0.73
DARD-ARGININEA1CW80.73
DARD-ARGININEA,B,C,D3BOG0.73
DARD-ARGININEA1BFW0.73
DARD-ARGININEA1BG00.73
CLH2-AMINO-6-[2-(2-OXO-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.7
NMM(R)-2-AMINO-5-(3-METHYLGUANIDINO)BUTANOIC ACIDA,B,D,E2V850.73
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA,B,C,D1YNI0.87
SUGN~2~-(3-CARBOXYPROPANOYL)-L-ARGININEA2P8C0.87
HMRBETA-HOMOARGININEI1ABI0.72
HMRBETA-HOMOARGININER1NRQ0.72
HMRBETA-HOMOARGININER1NRP0.72
HMRBETA-HOMOARGININEA3C3G0.72
HMRBETA-HOMOARGININEA3C3H0.72
2MRN3, N4-DIMETHYLARGININEA,B,D,E2V870.71
2MRN3, N4-DIMETHYLARGININEA,B,D,F2V880.71
2MRN3, N4-DIMETHYLARGININEA1G4H0.71
2MRN3, N4-DIMETHYLARGININEA1G420.71
2MRN3, N4-DIMETHYLARGININEA1G5F0.71
DA2NG,NG-DIMETHYL-L-ARGININEA,C,P,R2VPG0.73
DA2NG,NG-DIMETHYL-L-ARGININEA,B7NSE0.73
DA2NG,NG-DIMETHYL-L-ARGININEA,B,D,E2V860.73
DA2NG,NG-DIMETHYL-L-ARGININED2B2U0.73
OLN(S)-2-ACETAMIDO-5-UREIDOPENTANOIC ACIDA1YH10.76
1691-(4-TERT-BUTYLCARBAMOYL-PIPERAZINE-
1-CARBONYL)-3-(3-GUANIDINO-PROPYL)-
4-OXO-AZETIDINE-2-CARBOXYLIC ACID
A1RXP0.73
DP2L-LYSYL-N~5~-[(Z)-(2,2-DIHYDROXYHYDRAZINO)(IMINO)METHYL]-
L-ORNITHINAMIDE
A,B1RS80.71
DP2L-LYSYL-N~5~-[(Z)-(2,2-DIHYDROXYHYDRAZINO)(IMINO)METHYL]-
L-ORNITHINAMIDE
A,B1RS60.71
CLG2-AMINO-6-[2-(2-AMINOOXY-ACETYLAMINO)-
ACETYLAMINO]-HEXANOIC ACID
A,B1K090.72
CMAN2-(CARBOXYETHYL)-L-ARGININEA,B1JGT0.84
MGG2-(2-CARBOXY-ACETYLAMINO)-5-GUANIDINO-
PENTANOIC ACID
A1CVQ0.86
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G650.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6A0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G680.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG70.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEA2G6C0.71
SN0N-(3-CARBOXYPROPANOYL)-L-NORVALINEC,D,E,X,Y,Z2FG60.71
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z260.76
NCDN-CARBAMOYL-L-ASPARTATEA,B1J790.76
NCDN-CARBAMOYL-L-ASPARTATEA,B1XGE0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z290.76
NCDN-CARBAMOYL-L-ASPARTATEA,B,G,H1R0C0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z270.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z280.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z2A0.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z240.76
NCDN-CARBAMOYL-L-ASPARTATEA,B2Z250.76
AAGN-ALPHA-L-ACETYL-ARGININEA1DRY0.84
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.73
SVCN-ACETYL-L-LEUCYL-N-[(1S)-4-{[AMINO(IMINO)METHYL]AMINO}-
1-(HYDROXYMETHYL)BUTYL]-L-LEUCINAMIDE
A,B3BPM0.74
HRGL-HOMOARGININEA,B,C2VDN0.72
HRGL-HOMOARGININEA3DIQ0.72
HRGL-HOMOARGININEA,B1DM70.72
D20N~5~-{IMINO[(2-METHOXYETHYL)AMINO]METHYL}-
L-ORNITHINE
A,B2JAJ0.72
PCXDEOXYGUANIDINOPROCLAVAMINIC ACIDA1GVG0.82
PCXDEOXYGUANIDINOPROCLAVAMINIC ACIDA,B1MC10.82
C6LN-hexanoyl-L-homoserineA3DHA0.73
C6LN-hexanoyl-L-homoserineA3DHB0.73
CSIAMINO-(2-IMINO-HEXAHYDRO-PYRIMIDIN-
4-YL)-ACETIC ACID
A,B1KE20.74
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.71