Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00485861
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 |
A8B![]() | A | 1ODC | 0.73 | ![]() | |
HFT![]() | HYDROXYFLUTAMIDE | A | 2AX6 | 0.7 | ![]() |
NP1![]() | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.85 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.77 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.77 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.77 | ![]() |
NP2![]() | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.78 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.77 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.77 | ![]() |
DBP![]() | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.74 | ![]() |
BAN![]() | HONH-BENZYLMALONYL-L-ALANYLGLYCINE- P-NITROANILIDE | A | 5TLN | 0.75 | ![]() |
IXX![]() | 3-(5H-DIBENZO[B,F]AZEPIN-5-YL)- N,N-DIMETHYLPROPAN-1-AMINE | A | 2Q72 | 0.73 | ![]() |
DOF![]() | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1RMH | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1VBS | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | C | 1V9T | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1VBT | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1LOP | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1ZKF | 0.72 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1PIP | 0.72 | ![]() |
4NM![]() | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.71 | ![]() |
3CZ![]() | (2R)-1-[(4-tert-butylphenyl)sulfonyl]- 2-methyl-4-(4-nitrophenyl)piperazine | A,B | 3CZR | 0.73 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.7 | ![]() |
NPP![]() | N-(2-AMINO-ETHYL)-4,6-DINITRO-N'- (2,2,6,6-TETRAMETHYL-1-OXY-PIPERIDIN- 4-YL)-BENZENE-1,3-DIAMINE | L | 1BAF | 0.84 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.7 | ![]() |
HNT![]() | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.78 | ![]() |
IDM![]() | INDOLINE | A,B | 3CEP | 0.72 | ![]() |
IDM![]() | INDOLINE | A | 1AEK | 0.72 | ![]() |