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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03376809

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SKP5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-
4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-
1-ENECARBOXYLIC ACID		A2O0X0.74
SKP5-(1-CARBOXY-1-PHOSPHONOOXY-ETHOXYL)-
4-HYDROXY-3-PHOSPHONOOXY-CYCLOHEX-
1-ENECARBOXYLIC ACID		A1Q360.74
RC1[3R-[3A,4A,5B(R*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A2PQC0.75
RC1[3R-[3A,4A,5B(R*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A1X8T0.75
OLC(2R)-2,3-dihydroxypropyl (9Z)-octadec-
9-enoate		A3D4S0.72
11O(TRANS-12,13-EPOXY)-11-HYDROXY-
9(Z)-OCTADECENOIC ACID		A1IK30.73
EPS5-[(1-CARBOXYVINYL)OXY]-4-HYDROXY-
3-(PHOSPHONOOXY)CYCLOHEX-1-ENE-
1-CARBOXYLIC ACID		A2O0Z0.74
EPS5-[(1-CARBOXYVINYL)OXY]-4-HYDROXY-
3-(PHOSPHONOOXY)CYCLOHEX-1-ENE-
1-CARBOXYLIC ACID		A,B,C,D1QXO0.74
TG1A,B2AGV0.72
TG1A2ZBF0.72
TG1A2ZBG0.72
TG1A,B,C,D1WPG0.72
TG1A2C8L0.72
TG1A2EAR0.72
TG1A,B1IWO0.72
TG1A2C880.72
TG1A2DQS0.72
TG1A2C8K0.72
TG1A1XP50.72
TG1A2EAT0.72
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one		A3B2S0.71
13T13-DEOXYTEDANOLIDE0,1,3,9,A,B,
C,H,J,K,L,M,
N,O,Q,R,S,T,
U,Y,Z		2OTJ0.76
SC1[3R-[3A,4A,5B(S*)]]-5-(1-CARBOXY-
1-PHOSPHONOETHOXY)-4-HYDROXY-3-
(PHOSPHONOOXY)-1-CYCLOHEXENE-1-
CARBOXYLIC ACID		A1X8R0.75
KO2prop-2-en-1-yl D-glycero-alpha-
D-talo-oct-2-ulopyranosidonic acid		A,B2R2H0.76
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R1X0.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R2B0.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9Q0.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R230.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9T0.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B3BPC0.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9R0.74
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R1W0.74
KDEprop-2-en-1-yl 3-deoxy-beta-L-gulo-
oct-2-ulopyranosidonic acid		A2R2E0.74
PVC(2E,4R,5S)-2,3,4,5-TETRAHYDROXY-
6-(PALMITOYLOXY)HEX-2-ENOIC ACID		A1W3Y0.74
AB03,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13-
PENTADEOXY-4-O-(METHOXYMETHYL)-
L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID		H,L2E270.76
TSO(1R,3S,5S,8R)-8-HYDROXY-2-OXABICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B,C,D2W1A0.71
6OC(8R,9Z,12Z)-8-hydroxy-6-oxooctadeca-
9,12-dienoic acid		A,B2VV40.71
SPQ(3R,4S,5R)-5-{[(1R)-1-CARBOXY-2-
FLUORO-1-(PHOSPHONOOXY)ETHYL]OXY}-
4-HYDROXY-3-(PHOSPHONOOXY)CYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B,C,D1RF40.71
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE		A,B2HFK0.75
OVA3,4-DIHYDROXY-2-METHOXY-4-METHYL-
3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) -
OXIRANYL]-CYCLOHEXANONE		A2GZ50.71
OVA3,4-DIHYDROXY-2-METHOXY-4-METHYL-
3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) -
OXIRANYL]-CYCLOHEXANONE		A1B590.71
UNF4-O-(4-deoxy-beta-L-threo-hex-4-
enopyranuronosyl)-beta-D-galactopyranuronic acid		A,B2VZQ0.73
UNF4-O-(4-deoxy-beta-L-threo-hex-4-
enopyranuronosyl)-beta-D-galactopyranuronic acid		A2W470.73
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2IYR0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A3BAF0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A3DOO0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1U8A0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1ZUI0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2EV90.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B,C,D2HK90.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A,B2D5C0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYQ0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2AA90.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A1ZYU0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2GPT0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2G1K0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2AAY0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYX0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2DFN0.74
SKM(3R,4S,5R)-3,4,5-TRIHYDROXYCYCLOHEX-
1-ENE-1-CARBOXYLIC ACID		A2IYS0.74
KDRprop-2-en-1-yl 3-deoxy-alpha-D-
manno-octos-2-ulopyranoside		A,B2R1Y0.71
9OH(TRANS-12,13-EPOXY)-9-HYDROXY-10(E)-
OCTADECENOIC ACID		A1IK30.71
UNG4-O-(4-DEOXY-BETA-L-THREO-HEX-4-
ENOPYRANURONOSYL)-ALPHA-D-GALACTOPYRANURONIC ACID		A2UVI0.73
PULA2C780.75
RGCREIDISPONGIOLIDE CA2ASP0.76
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B1ECM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B,C,D,E,F,
G,H,I,J,K,L		2CHT0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		X2GTV0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		H1FIG0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B4CSM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		A,B3CSM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID		B2FP20.71
MPG1-MONOOLEOYL-RAC-GLYCEROLA2GUF0.72
MPG1-MONOOLEOYL-RAC-GLYCEROLA,B1E120.72
MRCMUPIROCINA1JZS0.74
MRCMUPIROCINA,T1FFY0.74
MRCMUPIROCINA1QU30.74
MRCMUPIROCINA,T1QU20.74