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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03348996

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3MP3-METHYLPYRIDINEA1EUB0.73
3MP3-METHYLPYRIDINEA1BM60.73
APY2-AMINOMETHYL-PYRIDINEA,B,I1HIV0.74
APY2-AMINOMETHYL-PYRIDINEI1IVP0.74
9CA9H-CARBAZOLEA,B,C,D,E,F2DE70.72
GVH1H-PYRROLO[2,3-B]PYRIDINEA2UVX0.71
MIB(3E)-4-(1-METHYL-1H-INDOL-3-YL)BUT-
3-EN-2-ONE
A1ZS50.71
ISQISOQUINOLINEA1GDK0.71
AUP2-(2-PHENYL-3-PYRIDIN-2-YL-4,5,6,7-
TETRAHYDRO-2H-ISOPHOSPHINDOL-1-
YL)PYRIDINE
A2AAQ0.7
NTNISONICOTINAMIDINEA7ADH0.71
2755-amino-1,2-dimethylpyridiniumX2RBW0.72
TSH2-(1H-INDOL-3-YL)ETHANIMINED,H2AGY0.82
TSH2-(1H-INDOL-3-YL)ETHANIMINED,H2AH00.82
TSH2-(1H-INDOL-3-YL)ETHANIMINED,H2AGX0.82
3IB3-INDOLEBUTYRIC ACIDA,B2AY60.71
3IB3-INDOLEBUTYRIC ACIDA,B,C,E2GJ60.71
5MP5-METHYLPYRROLEA1LI60.74
BVF4-METHYLPYRIDIN-2-AMINEA,B3E670.71
BVF4-METHYLPYRIDIN-2-AMINEA2EUT0.71
LG45-METHYLPYRIDIN-2-AMINEA2EUP0.7
2MI2-METHYL-1H-INDOLEA2PIO0.75
L123-(2-PYRIDIN-4-YLETHYL)-1H-INDOLEA1W840.8
2781-(1-methyl-1H-pyrrol-2-yl)methanamineX2RBV0.79
NCT(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T
1UW60.76
NCT(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINEA1P2Y0.76
NCT(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINEA1P7R0.76
TPLTRYPTOPHANOLA1EE70.72
PZZ3-{3-[(DIMETHYLAMINO)METHYL]-1H-
INDOL-7-YL}PROPAN-1-OL
A2QHW0.72
TSC(1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOLD,H2AH00.71
TSC(1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOLD,H2AGZ0.71
3AP3-AMINOPYRIDINEA1AEF0.73
0471-CYCLOHEXYL-N-{[1-(4-METHYLPHENYL)-
1H-INDOL-3-YL]METHYL}METHANAMINE
A,B2PJL0.74
8APN~3~-BENZYLPYRIDINE-2,3-DIAMINEA2OHM0.71
INDINDOLEA1L4H0.82
INDINDOLEA,B,G1O7N0.82
INDINDOLEA185L0.82
INDINDOLEA,B1EG90.82
INDINDOLEA,B1UUV0.82
INDINDOLEA,C,E2B240.82
INDINDOLEA,B,C,D,E,F2P850.82
2862-ethenyl-1-methylpyridiniumX2RC20.74
TSR2-(1H-INDOL-3-YL)ACETAMIDED,H2OJY0.74
TSR2-(1H-INDOL-3-YL)ACETAMIDEA,D,H2OIZ0.74
PBG3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)-
1H-PYRROL-3-YL]PROPANOIC ACID
A,B1E510.75
PBG3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)-
1H-PYRROL-3-YL]PROPANOIC ACID
A1OHL0.75
TSS2-(1H-INDOL-3-YL)ETHANAMINEA,B,D,H2IUQ0.82
TSS2-(1H-INDOL-3-YL)ETHANAMINEA,B2FPB0.82
TSS2-(1H-INDOL-3-YL)ETHANAMINED,H2AGW0.82
TSS2-(1H-INDOL-3-YL)ETHANAMINEA2PQL0.82
5171-{2-OXO-3-[(1R)-1-(1H-PYRROL-2-
YL)ETHYL]-2H-INDOL-5-YL}UREA
A2PE10.72
IPLINDOLE-3-PROPANOL PHOSPHATEA,B1BEU0.71
IPLINDOLE-3-PROPANOL PHOSPHATEA,B1QOP0.71
IPLINDOLE-3-PROPANOL PHOSPHATEA,B2TRS0.71
IPLINDOLE-3-PROPANOL PHOSPHATEA1WXJ0.71
IPLINDOLE-3-PROPANOL PHOSPHATEA,B1KFC0.71
LL13-pyridin-4-yl-1H-indazoleA3DNE0.71
PIM4-PHENYL-1H-IMIDAZOLEA,B2D0T0.73
PIM4-PHENYL-1H-IMIDAZOLEA1E9X0.73
PIM4-PHENYL-1H-IMIDAZOLEA1PHD0.73
PIM4-PHENYL-1H-IMIDAZOLEA,B,C,D2RFC0.73
PIM4-PHENYL-1H-IMIDAZOLEA1ODO0.73
PIM4-PHENYL-1H-IMIDAZOLEA3E5K0.73
PIM4-PHENYL-1H-IMIDAZOLEA1PHE0.73
PIM4-PHENYL-1H-IMIDAZOLEA,B1F4T0.73
PIM4-PHENYL-1H-IMIDAZOLEA1S1F0.73
PIM4-PHENYL-1H-IMIDAZOLEA1PHF0.73
6IP6-[2-(1H-INDOL-6-YL)ETHYL]PYRIDIN-
2-AMINE
A2OHP0.73
NPMN-[(1E)-PYRIDIN-2-YLMETHYLENE]-
N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE
A,B2ET00.7
11XN-(pyridin-3-ylmethyl)anilineA3EJ00.78
EPJEPIBATIDINEA,B,C,D,E2BYQ0.72
5IQISOQUINOLIN-5-AMINEA,B2F2T0.74
4AP4-AMINOPYRIDINEA1AEG0.74
LTNL-TRYPTOPHANAMIDEA1MAU0.74
LTNL-TRYPTOPHANAMIDEA,B2QUI0.74
LIG3-PYRIDIN-4-YL-2,4-DIHYDRO-INDENO[1,2-
.C.]PYRAZOLE
P1JVP0.71
GG54-[3-(4-FLUOROPHENYL)-1H-PYRAZOL-
4-YL]PYRIDINE
A3HVC0.73