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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00460763

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
REXGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANYL-D-ALANINE
A1IKG0.71
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W030.73
HCGDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-GLYCINE
A1W040.73
VB1N^6^-[(1R)-2-{[(1S)-1-carboxypropyl]amino}-
2-oxo-1-(sulfanylmethyl)ethyl]-
6-oxo-L-lysine
A2VBP0.74
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W050.74
W05DELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-D-ALANINE
A1W060.74
IP1ISOPENICILLIN NA1QJE0.7
CYKN-hexanoyl-L-homocysteineA3DHC0.73
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A3BHM0.71
AHE2-AMINO-4-[1-CARBOXYMETHYL-CARBAMOYL)-
2-HYDROXYMETHYLSULFANYL-ETHYLCARBAMOYL]-
BUTYRIC ACID
A,B1MC50.71
REYGLYCYL-L-ALPHA-AMINO-EPSILON-PIMELYL-
D-ALANINE
A1IKI0.72
AFJ(2R,4S,5S)-N-butyl-4-hydroxy-2,7-
dimethyl-5-{[N-(4-methylpentanoyl)-
L-methionyl]amino}octanamide
A,B,C3DUY0.75
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
GTYL-GAMMA-GLUTAMYL-S-OCTYL-D-CYSTEINYLGLYCINEA1U880.74
AXQ{(E)-(3R,6S,9R)-3-[(1S,3R)-3-((S)-
1 -BUTYLCARBAMOYL-2-METHYL-PROPYLCARB AMOYL)-
1-HYDROXY-BUTYL]-6-METHYL-5, 8-
DIOXO-1,11-DITHIA-4,7-DIAZA-CYCLO PENTADEC-
13-EN-9-YL}-CARBAMIC ACID TERT-
BUTYL ESTER
A,B,C2F3E0.74
GSML-GAMMA-GLUTAMYL-S-METHYLCYSTEINYLGLYCINEA,B,C,D2AB60.73
EPMN-PALMITOYL-L-METHIONINEA,B1ZO90.79
ACCN-[N-[2-AMINO-6-OXO-HEXANOIC ACID-
6-YL]CYSTEINYL]-S-METHYLCYSTEINE
A1QIQ0.76
LASN-acetyl-S-({(2R,3S,4R)-3-hydroxy-
2-[(1S)-1-hydroxy-2-methylpropyl]-
4-methyl-5-oxopyrrolidin-2-yl}carbonyl)cysteine
A,B3DPM0.71
HJ3(2R,4S)-2-[(1R)-1-{[(6S)-6-amino-
6-carboxyhexanoyl]amino}-2-oxoethyl]-
5,5-dimethyl-1,3-thiazolidine-4-
carboxylic acid
A3BEB0.75
BCVD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
D-CYCLOPROPYLGLYCINE
A2IVJ0.73
ACWD-(L-A-AMINOADIPOYL)-L-CYSTEINYL-
B-METHYL-D-CYCLOPROPYLGLYCINE
B2IVI0.74
HEL(2S,5R,6R)-6-{[(6R)-6-(GLYCYLAMINO)-
7-OXIDO-7-OXOHEPTANOYL]AMINO}-3,3-
DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLATE
A1PWG0.7
HEL(2S,5R,6R)-6-{[(6R)-6-(GLYCYLAMINO)-
7-OXIDO-7-OXOHEPTANOYL]AMINO}-3,3-
DIMETHYL-7-OXO-4-THIA-1-AZABICYCLO[3.2.0]HEPTANE-
2-CARBOXYLATE
A1PW10.7
ACS1-[(1S)-CARBOXY-2-(METHYLSULFINYL)ETHYL]-
(3R)-[(5S)-5-AMINO-5-CARBOXYPENTANAMIDO]-
(4R)-SULFANYLAZETIDIN-2-ONE
A1QJF0.7
HFVDELTA-(L-ALPHA-AMINOADIPOYL)-L-
CYSTEINYL-L-3,3,3,3',3',3'-HEXAFLUOROVALINE
A2BU90.7
PCJ(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-
1,2-DIYL DIHEXADECANOATE
A,N2Z810.7
PCJ(2R)-3-{[(2S)-3-HYDROXY-2-(PALMITOYLAMINO)PROPYL]THIO}PROPANE-
1,2-DIYL DIHEXADECANOATE
A,B,C2Z7X0.7
GTXS-HEXYLGLUTATHIONEA,B1K3Y0.75
GTXS-HEXYLGLUTATHIONEA,B1AGS0.75
GTXS-HEXYLGLUTATHIONEA,B1PN90.75
GTXS-HEXYLGLUTATHIONEA,B1Q4J0.75
GTXS-HEXYLGLUTATHIONEA,B2IMK0.75
GTXS-HEXYLGLUTATHIONEA,B4GSS0.75
GTXS-HEXYLGLUTATHIONEA,B,C1GWC0.75
GTXS-HEXYLGLUTATHIONEA,B,C,D2C3Q0.75
GTXS-HEXYLGLUTATHIONEA,B,C,D1TU80.75
GTXS-HEXYLGLUTATHIONEA,B2GLR0.75
GTXS-HEXYLGLUTATHIONEA,B2OA70.75
GTXS-HEXYLGLUTATHIONEA,C2AAW0.75
GTXS-HEXYLGLUTATHIONEA,B1VF20.75
GTXS-HEXYLGLUTATHIONEA1M9A0.75
GTXS-HEXYLGLUTATHIONEA,B17GS0.75
GTXS-HEXYLGLUTATHIONEA,B1K0A0.75
GTXS-HEXYLGLUTATHIONEA,B2R3X0.75
GTXS-HEXYLGLUTATHIONEA,B1GSU0.75
GTXS-HEXYLGLUTATHIONEA,B2C800.75
GTXS-HEXYLGLUTATHIONEA,B2R6K0.75
GTXS-HEXYLGLUTATHIONEA,B1PGT0.75
GTXS-HEXYLGLUTATHIONEA,B2J9H0.75
GTXS-HEXYLGLUTATHIONEA,B1K3L0.75
GTXS-HEXYLGLUTATHIONEA,B1GNW0.75
GTXS-HEXYLGLUTATHIONEA,B,C,D1BH50.75
GTXS-HEXYLGLUTATHIONEA,B1YDK0.75
GTXS-HEXYLGLUTATHIONEA,B9GSS0.75
LBYN~6~-(TERT-BUTOXYCARBONYL)-L-LYSINEA2ZIN0.71