Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01183216
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
KSM | N-(2-chloro-6-methylphenyl)-8-[(3S)- 3-methylpiperazin-1-yl]imidazo[1,5- a]quinoxalin-4-amine | A | 2ZM4 | 0.72 | |
5MB | 5-METHYLBENZIMIDAZOLE | A | 1JHM | 0.71 | |
M03 | 1-[4-(4-chlorophenyl)-1-(7H-pyrrolo[2,3- d]pyrimidin-4-yl)piperidin-4-yl]methanamine | A,I | 2VO0 | 0.73 | |
SCW | 3-bromo-6-phenyl-N-(pyrimidin-5- ylmethyl)imidazo[1,2-a]pyridin- 8-amine | A | 2R3L | 0.7 | |
1BN | 1-BENZYL-1H-IMIDAZOLE | A,B | 2AFX | 0.8 | |
SCE | 3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2- a]pyrazin-8-amine | A | 2R3H | 0.7 | |
STS | 2-[(1S)-1-BENZYL-2-SULFANYLETHYL]- 1H-IMIDAZO[4,5-C]PYRIDIN-5-IUM | A | 1Y8J | 0.71 | |
M05 | 4-(4-chlorobenzyl)-1-(7H-pyrrolo[2,3- d]pyrimidin-4-yl)piperidin-4-aminium | A | 2VO7 | 0.75 | |
M05 | 4-(4-chlorobenzyl)-1-(7H-pyrrolo[2,3- d]pyrimidin-4-yl)piperidin-4-aminium | A | 2VO6 | 0.75 | |
984 | CYCLOPROPYL-{4-[5-(3,4-DICHLOROPHENYL)- 2-[(1-METHYL)-PIPERIDIN]-4-YL-3- PROPYL-3H-IMIDAZOL-4-YL]-PYRIMIDIN- 2-YL}AMINE | A | 1PMN | 0.79 | |
EMU | N-BENZYL-9H-PURIN-6-AMINE | A | 1W1S | 0.7 | |
KSF | N-(2-chlorophenyl)-5-phenylimidazo[1,5- a]pyrazin-8-amine | A | 2ZM1 | 0.76 | |
GVK | 6-{4-[4-(4-CHLOROPHENYL)PIPERIDIN- 4-YL]PHENYL}-9H-PURINE | A | 2UW0 | 0.71 | |
C4E | N-phenyl-1H-pyrrolo[2,3-b]pyridin- 3-amine | A,B,C,D | 3C4E | 0.72 | |
SC9 | 6-(2-fluorophenyl)-N-(pyridin-3- ylmethyl)imidazo[1,2-a]pyrazin- 8-amine | A | 2R3G | 0.72 | |
SB5 | 4-(FLUOROPHENYL)-1-CYCLOPROPYLMETHYL- 5-(2-AMINO-4-PYRIMIDINYL)IMIDAZOLE | A | 1BMK | 0.71 | |
OWL | N-1H-imidazol-2-yl-N'-[4-(1H-imidazol- 2-ylamino)phenyl]benzene-1,4-diamine | A,G | 3FSI | 0.73 | |
ECN | 1-[(2S)-2-[(4-CHLOROBENZYL)OXY]- 2-(2,4-DICHLOROPHENYL)ETHYL]-1H- IMIDAZOLE | A,B | 2UVN | 0.71 | |
L23 | 4-[1-(2,6-dichlorobenzyl)-2-methyl- 1H-imidazol-4-yl]pyrimidin-2-amine | A,C | 2W71 | 0.8 | |
WAI | 4-{2-[4-(2-AMINOETHYL)PIPERAZIN- 1-YL]PYRIDIN-4-YL}-N-(3-CHLORO- 4-METHYLPHENYL)PYRIMIDIN-2-AMINE | A | 1Y2F | 0.71 | |
GVH | 1H-PYRROLO[2,3-B]PYRIDINE | A | 2UVX | 0.7 | |
HM2 | 5-CHLORO-6-METHYL-N-(2-PHENYLETHYL)- 2-PYRIDIN-2-YLPYRIMIDIN-4-AMINE | A | 2G6P | 0.71 | |
PFZ | 1-(N-IMIDAZOLYL)-2-HYDROXY-2-(2,3- DICHLOROPHENYL)OCTANE | A | 1PHA | 0.74 | |
PFZ | 1-(N-IMIDAZOLYL)-2-HYDROXY-2-(2,3- DICHLOROPHENYL)OCTANE | A | 1PHB | 0.74 | |
224 | 1-({2-[2-(4-CHLOROPHENYL)ETHYL]- 1,3-DIOXOLAN-2-YL}METHYL)-1H-IMIDAZOLE | A | 2DY5 | 0.72 | |
TMI | 1-[PHENYL-(4-PHENYLPHENYL)-METHYL]IMIDAZOLE | A | 2BDM | 0.76 | |
SB4 | 4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)- 5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE | A | 1BL7 | 0.71 | |
SB4 | 4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)- 5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE | A | 3ERK | 0.71 | |
MPI | IMIDAZO[1,2-A]PYRIDINE | A | 1AEM | 0.7 | |
23D | N2-[(1R,2S)-2-AMINOCYCLOHEXYL]- N6-(3-CHLOROPHENYL)-9-ETHYL-9H- PURINE-2,6-DIAMINE | A | 2IZT | 0.7 | |
23D | N2-[(1R,2S)-2-AMINOCYCLOHEXYL]- N6-(3-CHLOROPHENYL)-9-ETHYL-9H- PURINE-2,6-DIAMINE | A | 2CDZ | 0.7 | |
23D | N2-[(1R,2S)-2-AMINOCYCLOHEXYL]- N6-(3-CHLOROPHENYL)-9-ETHYL-9H- PURINE-2,6-DIAMINE | A,B | 2F57 | 0.7 | |
M04 | 1-[4-(4-chlorobenzyl)-1-(7H-pyrrolo[2,3- d]pyrimidin-4-yl)piperidin-4-yl]methanamine | A | 2VO3 | 0.74 | |
880 | CYCLOHEXYL-{4-[5-(3,4-DICHLOROPHENYL)- 2-PIPERIDIN-4-YL-3-PROPYL-3H-IMIDAZOL- 4-YL]-PYRIMIDIN-2-YL}AMINE | A | 1PMQ | 0.76 | |
XX5 | (S,S)-2-{1-CARBOXY-2-[3-(3,5-DICHLORO- BENZYL)-3H-IMIDAZOL-4-YL]-ETHYLAMINO}- 4-METHYL-PENTANOIC ACID | A | 1R4L | 0.72 | |
C4C | N-(4-chlorobenzyl)-N',N'-dimethyl- N-pyridin-2-ylethane-1,2-diamine | A | 2RA7 | 0.73 | |
CPZ | 4-(4-CHLOROPHENYL)IMIDAZOLE | A | 1SUO | 0.84 | |
1CI | 1-(4-CHLOROPHENYL)-1H-IMIDAZOLE | A,B,C,D,E,F,G | 2Q6N | 0.77 | |
PB2 | 1-(biphenyl-4-ylmethyl)-1H-imidazole | A,B,C,D | 3G93 | 0.76 | |
PB2 | 1-(biphenyl-4-ylmethyl)-1H-imidazole | A,B,C,D | 3G5N | 0.76 | |
ABI | 5-AMIDINO-BENZIMIDAZOLE | A | 1C2K | 0.72 | |
SB6 | 4-(4-FLUOROPHENYL)-1-CYCLOROPROPYLMETHYL- 5-(4-PYRIDYL)-IMIDAZOLE | A | 1BL6 | 0.71 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A,B | 2D0T | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 1E9X | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 1PHD | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A,B,C,D | 2RFC | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 1ODO | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 3E5K | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 1PHE | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A,B | 1F4T | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 1S1F | 0.78 | |
PIM | 4-PHENYL-1H-IMIDAZOLE | A | 1PHF | 0.78 |