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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02393699

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DEUCO(III)-(DEUTEROPORPHYRIN IX)A,B1PYZ0.7
DEUCO(III)-(DEUTEROPORPHYRIN IX)A,B1VL30.7
CRR3,4-DI-1H-INDOL-3-YL-1H-PYRROLE-
2,5-DICARBOXYLIC ACID
A2Z3U0.71
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1XWS0.7
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
B2BIK0.7
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1ZRZ0.7
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
B2BIL0.7
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1UU80.7
DHEHEME DA,B1DY70.74
DHEHEME DA,B1H9Y0.74
DHEHEME DA,B1HJ40.74
DHEHEME DA,B1HJ50.74
DHEHEME DA1HZU0.74
DHEHEME DA,B1HJ30.74
DHEHEME DA,B1N500.74
DHEHEME DA,B1NIR0.74
DHEHEME DA,B1E2R0.74
DHEHEME DA,B1AOM0.74
DHEHEME DA,B1AOF0.74
DHEHEME DA,B1N150.74
DHEHEME DA,B1GQ10.74
DHEHEME DA,B1NNO0.74
DHEHEME DA,B1H9X0.74
DHEHEME DA,B1QKS0.74
DHEHEME DA,B1BL90.74
DHEHEME DA,B1GJQ0.74
DHEHEME DA1HZV0.74
DHEHEME DA,B1HCM0.74
DHEHEME DA,B1N900.74
DHEHEME DA,B1AOQ0.74
BH1BACTERIOPHEOPHYTINH,L,M2BOZ0.78
BH1BACTERIOPHEOPHYTINA,B2BNS0.78
BH1BACTERIOPHEOPHYTINA,B2BNP0.78
CP3COPROPORPHYRIN IIIA1R3T0.8
CP3COPROPORPHYRIN IIIA1R3W0.8
CP3COPROPORPHYRIN IIIA1R3Y0.8
CP3COPROPORPHYRIN IIIA2Q710.8
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1GH00.83
CYCPHYCOCYANOBILINA,B2VJR0.83
CYCPHYCOCYANOBILINA,B,K,L,M,N1F990.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
H,I,J,K,L,M
1B330.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUM0.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUN0.83
CYCPHYCOCYANOBILINA,B2C7L0.83
CYCPHYCOCYANOBILINA,B,K,L1CPC0.83
CYCPHYCOCYANOBILINA,B1JBO0.83
CYCPHYCOCYANOBILINA,B1I7Y0.83
CYCPHYCOCYANOBILINA,B1ON70.83
CYCPHYCOCYANOBILINA,B,K,L1EYX0.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1HA70.83
CYCPHYCOCYANOBILINA,B1ALL0.83
CYCPHYCOCYANOBILINA,B1KTP0.83
CYCPHYCOCYANOBILINA,B2C7K0.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
2UUL0.83
CYCPHYCOCYANOBILINA2VEA0.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H,I,J,K,L
2VML0.83
CYCPHYCOCYANOBILINA2K2N0.83
CYCPHYCOCYANOBILINA,B2VJT0.83
CYCPHYCOCYANOBILINA,B1PHN0.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
G,H
3DBJ0.83
CYCPHYCOCYANOBILINA,B2G9M0.83
CYCPHYCOCYANOBILINA,B1KN10.83
CYCPHYCOCYANOBILINA,B,K,L1LIA0.83
CYCPHYCOCYANOBILINA,B,C,D,E,F,
K,L,M,N,O,P
2BV80.83
CYCPHYCOCYANOBILINA,B2C7J0.83
CYCPHYCOCYANOBILINA,B2V8A0.83
H02N-METHYL PROTOPORPHYRIN IX 2,4-
DISULFONIC ACID
A2Q3J0.8
BLVBILIVERDIN IX GAMMA CHROMOPHOREA1Z240.75
BLVBILIVERDIN IX GAMMA CHROMOPHOREA,B,C,D1BBP0.75
BLABILIVERDINE IX ALPHAA1HE20.8
BLABILIVERDINE IX ALPHAA1ZTU0.8
BLABILIVERDINE IX ALPHAA2D1E0.8
BLABILIVERDINE IX ALPHAA,B2C7J0.8
BLABILIVERDINE IX ALPHAA,B,K,L1EYX0.8
BLABILIVERDINE IX ALPHAA1BVC0.8
BLABILIVERDINE IX ALPHAA,B1KTP0.8
BLABILIVERDINE IX ALPHAA,B2C7K0.8
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
2UUL0.8
BLABILIVERDINE IX ALPHAA1S8C0.8
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
G,H
3C2W0.8
BLABILIVERDINE IX ALPHAA,B2C7L0.8
BLABILIVERDINE IX ALPHAA,B,C,D2VGR0.8
BLABILIVERDINE IX ALPHAA1J2C0.8
BLABILIVERDINE IX ALPHAA,B3BRP0.8
BLABILIVERDINE IX ALPHAA1BVD0.8
BLABILIVERDINE IX ALPHAA,B,K,L,M,N1F990.8
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
2UUM0.8
BLABILIVERDINE IX ALPHAA,B2VUE0.8
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
H,I,J,K,L,M
1B330.8
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
2UUN0.8
BLABILIVERDINE IX ALPHAA,B,C,D2VCK0.8
1FH12-PHENYLHEMEA,B1T5P0.73
1CPCOPROPORPHYRIN IA1R3S0.8
1CPCOPROPORPHYRIN IA1R3V0.8
1CPCOPROPORPHYRIN IA1R3Q0.8
DDH[7,12-DEACETYL-3,8,13,17-TETRAMETHYL-
21H,23H-PORPHINE-2,18-DIPROPANOATO(2-
)-N21,N22,N23,N24]-IRON
A,B,C,D1B860.75
DDH[7,12-DEACETYL-3,8,13,17-TETRAMETHYL-
21H,23H-PORPHINE-2,18-DIPROPANOATO(2-
)-N21,N22,N23,N24]-IRON
A1BJ90.75
2FH2-PHENYLHEMEA,B1S130.71
H01PROTOPORPHYRIN IX 2,4-DISULFONIC ACIDA2Q2N0.75
H01PROTOPORPHYRIN IX 2,4-DISULFONIC ACIDA2Q2O0.75
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.81
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.81
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.81
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.81
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.81
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.81
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.81
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.81
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
1PYH0.81
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.81
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.81
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.81
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.81
BPHBACTERIOPHEOPHYTIN AL,M1YF60.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.81
BPHBACTERIOPHEOPHYTIN AC1E140.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.81
BPHBACTERIOPHEOPHYTIN AL,M1PST0.81
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.81
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.81
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.81
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.81
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.81
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.81
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.81
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.81
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.81
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.81
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.81
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.81
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.81
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.81
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.81
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.81
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.81
BPHBACTERIOPHEOPHYTIN AC1E6D0.81
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.81
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.81
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.81
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.81
BPHBACTERIOPHEOPHYTIN AL,M1JH00.81
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.81
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.81
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.81
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.81
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.81
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.81
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.81
BPHBACTERIOPHEOPHYTIN AL,M1YST0.81
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.81
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.81
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.81
COHPROTOPORPHYRIN IX CONTAINING COA1YOG0.74
COHPROTOPORPHYRIN IX CONTAINING COA1DIY0.74
COHPROTOPORPHYRIN IX CONTAINING COX2O5T0.74
COHPROTOPORPHYRIN IX CONTAINING COA1FE20.74
COHPROTOPORPHYRIN IX CONTAINING COX2O5S0.74
COHPROTOPORPHYRIN IX CONTAINING COA,B2ZDP0.74
COHPROTOPORPHYRIN IX CONTAINING COA1YOI0.74
COHPROTOPORPHYRIN IX CONTAINING COA1U670.74
COHPROTOPORPHYRIN IX CONTAINING COA1YOH0.74
COHPROTOPORPHYRIN IX CONTAINING COA,B1LFM0.74
COHPROTOPORPHYRIN IX CONTAINING COA1IGZ0.74
COHPROTOPORPHYRIN IX CONTAINING COA,B,C,D1COH0.74
COHPROTOPORPHYRIN IX CONTAINING COA1IGX0.74
DBV15,16-DIHYDROBILIVERDINA,B,C,D1XF60.78
DBV15,16-DIHYDROBILIVERDINA,B,C,D1QGW0.78
DBV15,16-DIHYDROBILIVERDINA,B,C,D1XG00.78
FDEFE(III) DEUTEROPORPHYRIN IXX3C770.7
FDEFE(III) DEUTEROPORPHYRIN IXX2AT50.7
FDEFE(III) DEUTEROPORPHYRIN IXX2AT60.7