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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03159342

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		B,D2A540.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A3E5V0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		B,D2A560.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		B,D2A530.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		B,D2A500.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,G,H3CFH0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,C,D3E5W0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,C,D,E,F,
G,H		3BXC0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,G,H3CFF0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A3E5T0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,C,D,E,F,
G,H		3BXB0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		B,D2A520.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B2QLG0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B3BXA0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,C,D,E,F,
G,H		2V4E0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B2QLI0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B1UIS0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,C,D,E,F,
G,H		1ZGQ0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B,G,H3CFA0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B2QLH0.72
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B3BX90.72
RHP(3R)-3-(PROP-2-YNYLAMINO)INDAN-
5-OL		A,B1S3E0.7
843N-ACETYL-N-[1-(1,1'-BIPHENYL-4-
YLMETHYL)-2-OXOAZEPAN-3-YL]-O-PHOSPHONOTYROSINAMIDE		A1O420.71
YTT(3S,6S)-3,6-bis(4-hydroxybenzyl)piperazine-
2,5-dione		A3G5H0.76
TYPCYCLO-(L-TYROSINE-L-PROLINE) INHIBITORA,B1W1Y0.78
1092-(4-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)-
PROPIONIC ACID		A1G3C0.73
1092-(4-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)-
PROPIONIC ACID		A1G3E0.73
PNMOPEN FORM - PENICILLIN GA1GHP0.7
PNMOPEN FORM - PENICILLIN GA1PWC0.7
PNMOPEN FORM - PENICILLIN GA1IYQ0.7
PNMOPEN FORM - PENICILLIN GA1FQG0.7
PNMOPEN FORM - PENICILLIN GA,B,C,D2J8Y0.7
PNMOPEN FORM - PENICILLIN GA,B,C,D2JBF0.7
PNMOPEN FORM - PENICILLIN GA2EX80.7
GSOL-GAMMA-GLUTAMYL-S-[(2S)-2-HYDROXY-
2-PHENYLETHYL]-L-CYSTEINYLGLYCINE		A,B,C,D2C4J0.73
ZYABENZOYL-TYROSINE-ALANINE-METHYL KETONEA1AIM0.72
CJO[(2R,4R)-2-[(1R,2R)-1-amino-2-hydroxypropyl]-
4-(4-hydroxybenzyl)-5-oxoimidazolidin-
1-yl]acetic acid		A2QT20.75
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		A2Q630.72
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		B2Q640.72
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		B,D2R5Q0.72
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		A2PYN0.72
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		A2QAK0.72
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		A2PYM0.72
1UN2-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL SULFANYL-
BUTYL]-DECAHYDRO-ISOQUINOLINE-3-
CARBOXYLIC ACID TERT-BUTYLAMIDE		A1OHR0.72
C1NN-[(BENZYLOXY)CARBONYL]LEUCYL-N~1~-
[3-FLUORO-1-(4-HYDROXYBENZYL)-2-
OXOPROPYL]LEUCINAMIDE		A1ZCM0.71
MC1METHICILLIN ACYL-SERINEA,B1MWU0.73
PNNPENICILLIN GA,B1GM70.7
PNNPENICILLIN GB1FXV0.7
PNNPENICILLIN GA1UOF0.7
PNNPENICILLIN GA1UOB0.7
ABYN-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)-
L-CYSTEINYLGLYCINE		A,B1PL20.76
ABYN-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)-
L-CYSTEINYLGLYCINE		A,B1PL10.76
1082-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)-
PROPIONIC ACID		A1G3B0.73
1082-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)-
PROPIONIC ACID		A1G3D0.73
0E4N-acetyl-L-tyrosyl-L-valyl-L-alanyl-
L-aspartic acid		B,D3GJS0.74
PN1(2S,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-
3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLIC ACID		A1W2N0.72
PN1(2S,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-
3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLIC ACID		A1UNB0.72
IYGN-ALPHA-ACETYL-3,5-DIIODOTYROSYLGLYCINEA1OPM0.72
AXL2-{1-[2-AMINO-2-(4-HYDROXY-PHENYL)-
ACETYLAMINO]-2-OXO-ETHYL}-5,5-DIMETHYL-
THIAZOLIDINE-4-CARBOXYLIC ACID		B1LL90.83
K573-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL-BUTYRYL]-
5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID TERT-
BUTYLAMIDE		B1MRX0.77
K573-[2-HYDROXY-3-(3-HYDROXY-2-METHYL-
BENZOYLAMINO)-4-PHENYL-BUTYRYL]-
5,5-DIMETHYL-THIAZOLIDINE-4-CARBOXYLIC ACID TERT-
BUTYLAMIDE		A1MRW0.77
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B2AH80.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B,C,D1HCJ0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B,C,D1W7S0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B,C,D1W7T0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B2AHA0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A1EME0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B1KP50.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A1EMM0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A1EML0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B,C,D1W7U0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A,B,C,D1EMC0.75
CSY[4-(4-HYDROXY-BENZYL)-2-(2-HYDROXY-
1-METHYL-ETHYL)-5-OXO-IMIDAZOLIDIN-
1-YL]-ACETIC ACID		A2HPW0.75
CZO[(2R,4S)-2-[(1S,2R)-1-amino-2-hydroxypropyl]-
2-hydroxy-4-(4-hydroxybenzyl)-5-
oxoimidazolidin-1-yl]acetic acid		A2QRF0.74
G23(2R,4S)-2-[(R)-BENZYLCARBAMOYL-
PHENYLACETYL-METHYL]-5,5-DIMETHYL-
THIAZOLIDINE-4-CARBOXYLIC ACID		A1HTE0.73
AIC(2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-
3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLIC ACID		A2RDD0.72
AIC(2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-
3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLIC ACID		A,B,C,D1NX90.72
AIC(2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-
3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLIC ACID		A1H8S0.72
AIC(2S,5R,6R)-6-{[(2R)-2-AMINO-2-PHENYLETHANOYL]AMINO}-
3,3-DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLIC ACID		A2EX60.72
F1IN-[1-(2,6-dimethoxybenzyl)piperidin-
4-yl]-4-sulfanylbutanamide		A2ZJI0.74
JE2(R)-N-(2-METHYLBENZYL)-3-[(2S,3S)-
2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO-
4-PHENYLBUTANOYL]-5,5-DIMETHYL-
1,3-THIAZOLIDINE-4-CARBOXAMIDE		A,B1KZK0.76
JE2(R)-N-(2-METHYLBENZYL)-3-[(2S,3S)-
2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO-
4-PHENYLBUTANOYL]-5,5-DIMETHYL-
1,3-THIAZOLIDINE-4-CARBOXAMIDE		B1MSM0.76
JE2(R)-N-(2-METHYLBENZYL)-3-[(2S,3S)-
2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO-
4-PHENYLBUTANOYL]-5,5-DIMETHYL-
1,3-THIAZOLIDINE-4-CARBOXAMIDE		A,B2ANL0.76
JE2(R)-N-(2-METHYLBENZYL)-3-[(2S,3S)-
2-HYDROXY-3-(3-HYDROXY-2-METHYLBENZOYL)AMINO-
4-PHENYLBUTANOYL]-5,5-DIMETHYL-
1,3-THIAZOLIDINE-4-CARBOXAMIDE		B1MSN0.76
LIJBENZYL [(1S)-2-({(1S,2R)-1-BENZYL-
2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)-
2-OXO-1-{[(1-PROPYLBUTYL)SULFONYL]METHYL}ETHYL]CARBAMATE		A,B,C2HIZ0.73
CFY[(2S)-2-{(2R)-2-[(1S)-1-amino-2-
phenylethyl]-2-hydroxy-2,5-dihydro-
1,3-thiazol-4-yl}-4-(4-hydroxybenzyl)-
5-oxo-2,5-dihydro-1H-imidazol-1-
yl]acetic acid		A,B,C,D2ZMW0.75
CFY[(2S)-2-{(2R)-2-[(1S)-1-amino-2-
phenylethyl]-2-hydroxy-2,5-dihydro-
1,3-thiazol-4-yl}-4-(4-hydroxybenzyl)-
5-oxo-2,5-dihydro-1H-imidazol-1-
yl]acetic acid		A2ZMU0.75
CMQN~2~-[(BENZYLOXY)CARBONYL]-N-[(1S,2S)-
2-HYDROXY-1-(4-HYDROXYBENZYL)PROPYL]-
L-LEUCINAMIDE		A,B,C,D,E,F,
G,H,I,J,K,L,
M,N		2FZS0.71
CTACYCLOTHEONAMIDE AA1TYN0.7
G262-(BENZYLCARBAMOYL-PHENYLACETYLAMINO-
METHYL)-5,5-DIMETHYL-THIAZOLIDINE-
4-CARBOXYLIC ACID (HYDROXYMETHYL-
2-PHENYLETHYL)AMIDE		A,B1HTF0.72
CCY2-(1-AMINO-2-MERCAPTO-ETHYL)-5-
(4-HYDROXY-BENZYL)-3-(ETHANOYL)-
3,5-DIHYDRO-IMIDAZOL-4-ONE		A1EMK0.78
TYCL-TYROSINAMIDEA2BF90.72
TYCL-TYROSINAMIDEA2OCI0.72
NLTN-DODECANOYL-L-TYROSINEA,B,C,D,E,F,
G,H		2G0B0.74
006(4R)-3-[(2S,3S)-3-{[(2,6-dimethylphenoxy)acetyl]amino}-
2-hydroxy-4-phenylbutanoyl]-N-[(1S,2R)-
2-hydroxy-2,3-dihydro-1H-inden-
1-yl]-5,5-dimethyl-1,3-thiazolidine-
4-carboxamide		A,B,C,D3FNU0.72
SD2N-(SULFANYLACETYL)TYROSYLPROLYLMETHIONINAMIDEA,B1PWQ0.86
CRVN-[1-(AMINOMETHYL)CYCLOPROPYL]-
3-(BENZYLSULFONYL)-N~2~-[(1S)-2,2,2-
TRIFLUORO-1-(4-HYDROXYPHENYL)ETHYL]-
L-ALANINAMIDE		A,B2FRA0.79
OPTS-benzyl-N-(biphenyl-4-ylacetyl)-
L-cysteinyl-N~5~-(diaminomethyl)-
D-ornithyl-N-(2-phenylethyl)-L-
tyrosinamide		A,B3BC30.74
TI2(2-SULFANYL-3-PHENYLPROPANOYL)-
PHE-TYR		A1QF00.76
PI5N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-
OXA-6,9-DIAZA-BICYCLO[11.2.2]HEPTADECA-
1(16),13(17),14- TRIEN-11-YLAMINO)-
2-HYDROXY-1-(4-HYDROXY-BENZYL)-
PROPYL]-3-METHYL-2- (2-OXO-PYRROLIDIN-
1-YL)-BUTYRAMIDE		A,B1B6K0.7
ARYARYLOMYCIN A2A,B1T7D0.71
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A2H5Q0.74
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A1XQM0.74
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A,B2QLG0.74
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid		A1XA90.74