Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00518333
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 |
301![]() | N6-(penta-2,3-dienyl)adenine | A | 3BW7 | 0.78 | ![]() |
4MZ![]() | 4-METHYLIMIDAZOLE | A | 1DTM | 0.71 | ![]() |
4MZ![]() | 4-METHYLIMIDAZOLE | A,B | 1KEQ | 0.71 | ![]() |
4MZ![]() | 4-METHYLIMIDAZOLE | A | 2FNN | 0.71 | ![]() |
4MZ![]() | 4-METHYLIMIDAZOLE | A | 1MOO | 0.71 | ![]() |
4MZ![]() | 4-METHYLIMIDAZOLE | A | 1G0E | 0.71 | ![]() |
HDU![]() | N-[4-(2-METHYLIMIDAZO[1,2-A]PYRIDIN- 3-YL)-2-PYRIMIDINYL]ACETAMIDE | A | 1OIQ | 0.73 | ![]() |
5MB![]() | 5-METHYLBENZIMIDAZOLE | A | 1JHM | 0.71 | ![]() |
SB4![]() | 4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)- 5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE | A | 1BL7 | 0.72 | ![]() |
SB4![]() | 4-(4-FLUOROPHENYL)-1-(4-PIPERIDINYL)- 5-(2-AMINO-4-PYRIMIDINYL)-IMIDAZOLE | A | 3ERK | 0.72 | ![]() |
6MP![]() | 6-METHYLPURINE | A,B,C | 1OU4 | 0.76 | ![]() |
6MP![]() | 6-METHYLPURINE | A,B,C | 1OTY | 0.76 | ![]() |
6MP![]() | 6-METHYLPURINE | A | 2PUA | 0.76 | ![]() |
L0D![]() | 2-(1H-pyrazol-3-yl)-1H-benzimidazole | A | 2W1D | 0.7 | ![]() |
EA1![]() | 3H-IMIDAZO[2,1-I]PURINE | A,B | 1PU8 | 0.7 | ![]() |
A13![]() | 4-METHYL-6-(TRIFLUOROMETHYL)PYRIMIDIN- 2-AMINE | A | 2QFO | 0.72 | ![]() |
HA8![]() | N6-(buta-2,3-dienyl)adenine | A | 3C0P | 0.75 | ![]() |
EMU![]() | N-BENZYL-9H-PURIN-6-AMINE | A | 1W1S | 0.7 | ![]() |
SCE![]() | 3-methyl-N-(pyridin-4-ylmethyl)imidazo[1,2- a]pyrazin-8-amine | A | 2R3H | 0.73 | ![]() |
9DA![]() | 9-DEAZAADENINE | A | 1L1R | 0.78 | ![]() |
9DA![]() | 9-DEAZAADENINE | A | 1L1Q | 0.78 | ![]() |
C4E![]() | N-phenyl-1H-pyrrolo[2,3-b]pyridin- 3-amine | A,B,C,D | 3C4E | 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 | ![]() |
ABI![]() | 5-AMIDINO-BENZIMIDAZOLE | A | 1C2K | 0.71 | ![]() |
JNF![]() | N-cyclohexyl-4-imidazo[1,2-a]pyridin- 3-yl-N-methylpyrimidin-2-amine | A | 3CGF | 0.72 | ![]() |
JNO![]() | 2-{4-[(4-imidazo[1,2-a]pyridin- 3-ylpyrimidin-2-yl)amino]piperidin- 1-yl}-N-methylacetamide | A | 3CGO | 0.71 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A,B | 2D0T | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 1E9X | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 1PHD | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A,B,C,D | 2RFC | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 1ODO | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 3E5K | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 1PHE | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A,B | 1F4T | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 1S1F | 0.76 | ![]() |
PIM![]() | 4-PHENYL-1H-IMIDAZOLE | A | 1PHF | 0.76 | ![]() |
ZIP![]() | N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN- 6-AMINE | A | 1W1Q | 0.73 | ![]() |
ZIP![]() | N-(3-METHYLBUT-2-EN-1-YL)-9H-PURIN- 6-AMINE | A | 2EXM | 0.73 | ![]() |
BZI![]() | BENZIMIDAZOLE | A | 1RYC | 0.73 | ![]() |
BZI![]() | BENZIMIDAZOLE | A | 1L5F | 0.73 | ![]() |
BZI![]() | BENZIMIDAZOLE | A | 1KXM | 0.73 | ![]() |
AHN![]() | N-[2-(1H-IMIDAZOL-4-YL)ETHYL]ACETAMIDE | A,B | 2AFW | 0.73 | ![]() |
STS![]() | 2-[(1S)-1-BENZYL-2-SULFANYLETHYL]- 1H-IMIDAZO[4,5-C]PYRIDIN-5-IUM | A | 1Y8J | 0.72 | ![]() |
CQW![]() | 5-(5-chloro-7H-pyrrolo[2,3-d]pyrimidin- 4-yl)-4,5,6,7-tetrahydro-1H-imidazo[4,5- c]pyridine | A | 3CQW | 0.72 | ![]() |
FRV![]() | 4-{[4-(1-CYCLOPROPYL-2-METHYL-1H- IMIDAZOL-5-YL)PYRIMIDIN-2-YL]AMINO}- N-METHYLBENZENESULFONAMIDE | A | 2W06 | 0.7 | ![]() |
DMD![]() | 5,6-DIMETHYLBENZIMIDAZOLE | A | 1D0S | 0.7 | ![]() |
CPZ![]() | 4-(4-CHLOROPHENYL)IMIDAZOLE | A | 1SUO | 0.7 | ![]() |
P29![]() | 4-(2-(1H-IMIDAZOL-4-YL)ETHYLAMINO)- 2-(PHENYLAMINO)PYRAZOLO[1,5-A][1,3,5]TRIAZINE- 8-CARBONITRILE | A | 2PVM | 0.7 | ![]() |
HSM![]() | HISTAMINE | A,B | 1U18 | 0.78 | ![]() |
HSM![]() | HISTAMINE | A | 1AVN | 0.78 | ![]() |
HSM![]() | HISTAMINE | A,B | 1KAR | 0.78 | ![]() |
HSM![]() | HISTAMINE | A,B | 1NP1 | 0.78 | ![]() |
HSM![]() | HISTAMINE | A,B | 1JQD | 0.78 | ![]() |
HSM![]() | HISTAMINE | A,B | 2QEB | 0.78 | ![]() |
HSM![]() | HISTAMINE | A,B | 1QFV | 0.78 | ![]() |
HSM![]() | HISTAMINE | A | 1IKE | 0.78 | ![]() |
HSM![]() | HISTAMINE | A | 3BU1 | 0.78 | ![]() |
HSM![]() | HISTAMINE | A,B | 1QFT | 0.78 | ![]() |
GVI![]() | N-METHYL-1-[4-(9H-PURIN-6-YL)PHENYL]METHANAMINE | A | 2UVY | 0.71 | ![]() |
MPI![]() | IMIDAZO[1,2-A]PYRIDINE | A | 1AEM | 0.73 | ![]() |
2BP![]() | 9H-purin-2-amine | A | 3G4M | 0.74 | ![]() |