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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02493688

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDA,B,C,D1XES0.7
3IO3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACIDB,C,D1XET0.7
BI43-(1H-INDOL-3-YL)-4-{1-[2-(1-METHYLPYRROLIDIN-
2-YL)ETHYL]-1H-INDOL-3-YL}-1H-PYRROLE-
2,5-DIONE
A,B1SZM0.72
BI23-(1H-INDOL-3-YL)-4-(1-{2-[(2S)-
1-METHYLPYRROLIDINYL]ETHYL}-1H-
INDOL-3-YL)-1H-PYRROLE-2,5-DIONE
A1UU70.72
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1XWS0.72
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
B2BIK0.72
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1ZRZ0.72
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
B2BIL0.72
BI13-{1-[3-(DIMETHYLAMINO)PROPYL]-
1H-INDOL-3-YL}-4-(1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1UU80.72
6HE6-METHY-6-DEPROPIONATEHEMINA2ZAW0.7
6HE6-METHY-6-DEPROPIONATEHEMINA2EKT0.7
9CA9H-CARBAZOLEA,B,C,D,E,F2DE70.7
BLVBILIVERDIN IX GAMMA CHROMOPHOREA1Z240.78
BLVBILIVERDIN IX GAMMA CHROMOPHOREA,B,C,D1BBP0.78
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.71
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.71
2FH2-PHENYLHEMEA,B1S130.7
7HE7-METHYL-7-DEPROPIONATEHEMINA2EKU0.71
7HE7-METHYL-7-DEPROPIONATEHEMINA2Z970.71
1CPCOPROPORPHYRIN IA1R3S0.78
1CPCOPROPORPHYRIN IA1R3V0.78
1CPCOPROPORPHYRIN IA1R3Q0.78
BLABILIVERDINE IX ALPHAA1HE20.77
BLABILIVERDINE IX ALPHAA1ZTU0.77
BLABILIVERDINE IX ALPHAA2D1E0.77
BLABILIVERDINE IX ALPHAA,B2C7J0.77
BLABILIVERDINE IX ALPHAA,B,K,L1EYX0.77
BLABILIVERDINE IX ALPHAA1BVC0.77
BLABILIVERDINE IX ALPHAA,B1KTP0.77
BLABILIVERDINE IX ALPHAA,B2C7K0.77
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
2UUL0.77
BLABILIVERDINE IX ALPHAA1S8C0.77
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
G,H
3C2W0.77
BLABILIVERDINE IX ALPHAA,B2C7L0.77
BLABILIVERDINE IX ALPHAA,B,C,D2VGR0.77
BLABILIVERDINE IX ALPHAA1J2C0.77
BLABILIVERDINE IX ALPHAA,B3BRP0.77
BLABILIVERDINE IX ALPHAA1BVD0.77
BLABILIVERDINE IX ALPHAA,B,K,L,M,N1F990.77
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
2UUM0.77
BLABILIVERDINE IX ALPHAA,B2VUE0.77
BLABILIVERDINE IX ALPHAA,B,C,D,E,F,
H,I,J,K,L,M
1B330.77
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
2UUN0.77
BLABILIVERDINE IX ALPHAA,B,C,D2VCK0.77
2S2(2S)-2-(1H-indol-3-yl)hexanoic acidB3C6O0.71
2S3(2S)-2-(1H-indol-3-yl)pentanoic acidB3C6P0.71
BI33-[1-(3-AMINOPROPYL)-1H-INDOL-3-
YL]-4-(1H-INDOL-3-YL)-1H-PYRROLE-
2,5-DIONE
A1UU90.72
BI83-[1-(3-AMINOPROPYL)-1H-INDOL-3-
YL]-4-(1-METHYL-1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A,B2VD50.71
BI83-[1-(3-AMINOPROPYL)-1H-INDOL-3-
YL]-4-(1-METHYL-1H-INDOL-3-YL)-
1H-PYRROLE-2,5-DIONE
A1UVR0.71
4FW4-FLUOROTRYPTOPHANEA1RM90.71
4IN4-AMINO-L-TRYPTOPHANA,B2HXX0.73
4IN4-AMINO-L-TRYPTOPHANA1OXF0.73
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.71
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.71
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.71
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.71
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.71
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.71
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.71
1FH12-PHENYLHEMEA,B1T5P0.72