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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03427206

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.75
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.75
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.75
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.75
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.75
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.75
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.75
VX32,3-diphenyl-1H-indole-7-carboxylic acidA3BGZ0.73
PUBPHYCOUROBILINA,B,K,L1B8D0.71
PUBPHYCOUROBILINA,B,K,L1LIA0.71
PUBPHYCOUROBILINA,B,K,L1EYX0.71
PUBPHYCOUROBILINA,B,C,D2VJH0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.75
BPHBACTERIOPHEOPHYTIN A1,2,3,5,6,7,
8,A,B,D,E,F,
G,H,I,J,K,L,
M,N,P,R,S,T,
U,V,W,Y
1PYH0.75
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.75
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.75
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.75
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.75
BPHBACTERIOPHEOPHYTIN AL,M1YF60.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.75
BPHBACTERIOPHEOPHYTIN AC1E140.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.75
BPHBACTERIOPHEOPHYTIN AL,M1PST0.75
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.75
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.75
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.75
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.75
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.75
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.75
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.75
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.75
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.75
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.75
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.75
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.75
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.75
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.75
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.75
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.75
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.75
BPHBACTERIOPHEOPHYTIN AC1E6D0.75
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.75
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.75
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.75
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.75
BPHBACTERIOPHEOPHYTIN AL,M1JH00.75
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.75
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.75
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.75
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.75
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.75
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.75
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.75
BPHBACTERIOPHEOPHYTIN AL,M1YST0.75
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.75
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.75
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.75
IDA(2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO-
INDOL-7-YL)ACETIC ACID
A,B1OXL0.71
BH1BACTERIOPHEOPHYTINH,L,M2BOZ0.78
BH1BACTERIOPHEOPHYTINA,B2BNS0.78
BH1BACTERIOPHEOPHYTINA,B2BNP0.78
PVNPHYCOVIOLOBILINA,B2J960.72
E093-HYDROXYMETHYL-5-AZIRIDINYL-1METHYL-
2-[1H-INDOLE-4,7-DIONE]-PROPANOL
A,B,C,D1GG50.71
ICO1H-INDOLE-3-CARBOXYLIC ACIDL2PIP0.72
PEBPHYCOERYTHROBILINA,B1PHN0.7
PEBPHYCOERYTHROBILINA,B,C,D1QGW0.7
PEBPHYCOERYTHROBILINA,B,C,D1XG00.7
PEBPHYCOERYTHROBILINA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.7
PEBPHYCOERYTHROBILINA,B,C,D2VJH0.7
PEBPHYCOERYTHROBILINA,B,K,L,M,N1F990.7
PEBPHYCOERYTHROBILINA,B,K,L1B8D0.7
PEBPHYCOERYTHROBILINA,B,C,D1XF60.7
BLABILIVERDINE IX ALPHAA1HE20.72
BLABILIVERDINE IX ALPHAA1ZTU0.72
BLABILIVERDINE IX ALPHAA2D1E0.72
BLABILIVERDINE IX ALPHAA,B2C7J0.72
BLABILIVERDINE IX ALPHAA,B,K,L1EYX0.72
BLABILIVERDINE IX ALPHAA1BVC0.72
BLABILIVERDINE IX ALPHAA,B1KTP0.72
BLABILIVERDINE IX ALPHAA,B2C7K0.72
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUL0.72
BLABILIVERDINE IX ALPHAA1S8C0.72
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
G,H
3C2W0.72
BLABILIVERDINE IX ALPHAA,B2C7L0.72
BLABILIVERDINE IX ALPHAA,B,C,D2VGR0.72
BLABILIVERDINE IX ALPHAA1J2C0.72
BLABILIVERDINE IX ALPHAA,B3BRP0.72
BLABILIVERDINE IX ALPHAA1BVD0.72
BLABILIVERDINE IX ALPHAA,B,K,L,M,N1F990.72
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUM0.72
BLABILIVERDINE IX ALPHAA,B2VUE0.72
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
H,I,J,K,L,M
1B330.72
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUN0.72
BLABILIVERDINE IX ALPHAA,B,C,D2VCK0.72
PQQPYRROLOQUINOLINE QUINONEA,B1CQ10.7
PQQPYRROLOQUINOLINE QUINONEA,B1OTW0.7
PQQPYRROLOQUINOLINE QUINONEA,B1C9U0.7
PQQPYRROLOQUINOLINE QUINONEA,C1W6S0.7
PQQPYRROLOQUINOLINE QUINONEA,B1FLG0.7
PQQPYRROLOQUINOLINE QUINONEA1KV90.7
PQQPYRROLOQUINOLINE QUINONEA,C2AD60.7
PQQPYRROLOQUINOLINE QUINONEA,B1CRU0.7
PQQPYRROLOQUINOLINE QUINONEA,C1H4I0.7
PQQPYRROLOQUINOLINE QUINONEA,C2AD70.7
PQQPYRROLOQUINOLINE QUINONEA,C2AD80.7
PQQPYRROLOQUINOLINE QUINONEA,D,I2D0V0.7
PQQPYRROLOQUINOLINE QUINONEA,C4AAH0.7
PQQPYRROLOQUINOLINE QUINONEA,C,E,G1H4J0.7
PQQPYRROLOQUINOLINE QUINONEA1KB00.7
PQQPYRROLOQUINOLINE QUINONEA1YIQ0.7
PQQPYRROLOQUINOLINE QUINONEA,C1LRW0.7
PQQPYRROLOQUINOLINE QUINONEA,C1G720.7
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1GH00.72
CYCPHYCOCYANOBILINA,B2VJR0.72
CYCPHYCOCYANOBILINA,B,K,L,M,N1F990.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
H,I,J,K,L,M
1B330.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUM0.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUN0.72
CYCPHYCOCYANOBILINA,B2C7L0.72
CYCPHYCOCYANOBILINA,B,K,L1CPC0.72
CYCPHYCOCYANOBILINA,B1JBO0.72
CYCPHYCOCYANOBILINA,B1I7Y0.72
CYCPHYCOCYANOBILINA,B1ON70.72
CYCPHYCOCYANOBILINA,B,K,L1EYX0.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1HA70.72
CYCPHYCOCYANOBILINA,B1ALL0.72
CYCPHYCOCYANOBILINA,B1KTP0.72
CYCPHYCOCYANOBILINA,B2C7K0.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUL0.72
CYCPHYCOCYANOBILINA2VEA0.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L
2VML0.72
CYCPHYCOCYANOBILINA2K2N0.72
CYCPHYCOCYANOBILINA,B2VJT0.72
CYCPHYCOCYANOBILINA,B1PHN0.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H
3DBJ0.72
CYCPHYCOCYANOBILINA,B2G9M0.72
CYCPHYCOCYANOBILINA,B1KN10.72
CYCPHYCOCYANOBILINA,B,K,L1LIA0.72
CYCPHYCOCYANOBILINA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.72
CYCPHYCOCYANOBILINA,B2C7J0.72
CYCPHYCOCYANOBILINA,B2V8A0.72
MOCCARBAMIC ACID 2,6-DIAMINO-5-METHYL-
4,7-DIOXO-2,3,4,7-TETRAHYDRO-1H-
3A-AZA-CYCLOPENTA[A]INDEN-8-YLMETHYL ESTER
A199D0.74
TBV3-[2-[[3-(2-CARBOXYETHYL)-5-[[3-
ETHENYL-4-METHYL-5-[(2-METHYLPROPAN-
2-YL)OXY]-1H-PYRROL-2-YL]METHYL]-
4-METHYL-1H-PYRROL-2-YL]METHYL]-
5-[(Z)-(4-ETHENYL-3-METHYL-5-OXO-
PYRROL-2-YLIDENE)METHYL]-4-METHYL-
1H-PYRROL-3-YL]PROPANOIC ACID
A2WD40.72
MBVMESOBILIVERDIN IV ALPHAA1HE30.73
PHOPHEOPHYTIN AA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.74
PHOPHEOPHYTIN AZ1W5C0.74
PHOPHEOPHYTIN AA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.74
PHOPHEOPHYTIN AA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.74
PHOPHEOPHYTIN A0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
J,K,V
1S5L0.74
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.74
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1FE10.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.74
PBG3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)-
1H-PYRROL-3-YL]PROPANOIC ACID
A,B1E510.7
PBG3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)-
1H-PYRROL-3-YL]PROPANOIC ACID
A1OHL0.7
3DE3,5-DIMETHYL-1-PHENYL-1H-PYRAZOLE-
4-CARBOXYLIC ACID ETHYL ESTER
A,B1Y2C0.72
LBVA2O9B0.72
LBVA,B2OOL0.72
LBVA2O9C0.72
225FELODIPINEA2NNJ0.71
5DE1-(4-AMINOPHENYL)-3,5-DIMETHYL-
1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
A,B1Y2E0.71