Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00812476
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 |
IS2![]() | [(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID | A | 1O4J | 0.7 | ![]() |
SHH![]() | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A | 1C3S | 0.74 | ![]() |
SHH![]() | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A,B,C | 3C0Z | 0.74 | ![]() |
SHH![]() | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A | 1T69 | 0.74 | ![]() |
SHH![]() | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A,B,C,D | 1ZZ1 | 0.74 | ![]() |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.73 | ![]() |
NPB![]() | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.73 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.71 | ![]() |
NP1![]() | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.72 | ![]() |
HFT![]() | HYDROXYFLUTAMIDE | A | 2AX6 | 0.74 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.74 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.74 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.71 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1RSM | 0.73 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GVY | 0.73 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GW1 | 0.73 | ![]() |
BHM![]() | (R)-3-BROMO-2-HYDROXY-2-METHYL- N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE | A | 2AX9 | 0.71 | ![]() |
NP2![]() | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.77 | ![]() |
PNQ![]() | P-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D0Z | 0.73 | ![]() |
MNQ![]() | M-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D0X | 0.71 | ![]() |
01W![]() | (2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoate | A,B | 3DS9 | 0.73 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1RMH | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1VBS | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | C | 1V9T | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1VBT | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1LOP | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1ZKF | 0.78 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1PIP | 0.78 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 3E85 | 0.74 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 2ZJF | 0.74 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 2BMQ | 0.73 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 3BGU | 0.73 | ![]() |
PND![]() | P-NITROPHENYLHYDRAZINE | A,G | 1JMZ | 0.73 | ![]() |
PL0![]() | 1-phenylguanidine | A | 2O8W | 0.7 | ![]() |
PHJ![]() | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.85 | ![]() |