Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00594819
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 |
RKA | N,N'-(1H-PYRROLE-2,5-DIYLDI-4,1- PHENYLENE)DIBENZENECARBOXIMIDAMIDE | A | 2GYX | 0.73 | |
2AQ | QUINOLIN-2-AMINE | A | 2OHL | 0.72 | |
ZAT | 4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE) | A | 2W0J | 0.74 | |
GP6 | 1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA | A | 1BJU | 0.72 | |
PRY | 2-PROPYL-ANILINE | A | 1OWY | 0.72 | |
IXX | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.76 | |
4PG | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.72 | |
BSU | 1,3-DIPHENYLUREA | A | 3E85 | 0.71 | |
BSU | 1,3-DIPHENYLUREA | A | 2ZJF | 0.71 | |
XYD | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.7 | |
XYD | 2,5-DIMETHYLANILINE | A | 1L4L | 0.7 | |
PBZ | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.74 | |
PBZ | P-AMINO BENZAMIDINE | A | 1RFN | 0.74 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.74 | |
PBZ | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.74 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIZ | 0.74 | |
PBZ | P-AMINO BENZAMIDINE | A | 1FIW | 0.74 | |
PBZ | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.74 | |
AFF | 2-ACETYLAMINOFLUORENE-3-YL | A | 2GE2 | 0.71 | |
DAP | 6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE | A | 1D30 | 0.7 | |
DAP | 6-AMIDINE-2-(4-AMIDINO-PHENYL)INDOLE | A | 432D | 0.7 | |
CVI | CRYSTAL VIOLET | A,B,D,E | 1JTX | 0.77 | |
IET | 1-(4-CYANO-PHENYL)-3-[2-(2,6-DICHLORO- PHENYL)-1-IMINO-ETHYL]-THIOUREA | A | 1S6P | 0.72 | |
TPM | 2-(4-AMINOBENZYLAMINO)-3,4,5,6- TETRAHYDROPYRIDINIUM | J,K,L | 1F3D | 0.83 | |
PL0 | 1-phenylguanidine | A | 2O8W | 0.73 | |
IDM | INDOLINE | A,B | 3CEP | 0.74 | |
IDM | INDOLINE | A | 1AEK | 0.74 | |
23M | 2-(3-METHYLPHENYL)-1H-INDOLE-5- CARBOXIMIDAMIDE | A | 2G5N | 0.7 | |
MGR | MALACHITE GREEN | A,B | 3BQZ | 0.77 | |
MGR | MALACHITE GREEN | A | 1Q8N | 0.77 | |
MGR | MALACHITE GREEN | A,B | 3BR0 | 0.77 | |
MGR | MALACHITE GREEN | A,D,E | 3BTL | 0.77 | |
MGR | MALACHITE GREEN | A,B,D,E | 3BTC | 0.77 | |
MGR | MALACHITE GREEN | A,B,D,E | 1JUP | 0.77 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.79 | |
DSM | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.79 | |
SII | N-(4-{[4-(cyclohexylamino)-1-(3- fluorophenyl)-2-oxo-1,3,8-triazaspiro[4.5]dec- 3-en-8-yl]methyl}phenyl)acetamide | A | 3FKT | 0.7 | |
A8B | A | 1ODC | 0.71 | ||
AU4 | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.76 | |
BRN | BERENIL | A,B | 268D | 0.73 | |
BRN | BERENIL | A,B | 1D63 | 0.73 | |
BRN | BERENIL | A,D,E | 2GBY | 0.73 | |
BRN | BERENIL | A | 2DBE | 0.73 | |
BRN | BERENIL | A | 2GVR | 0.73 |