Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02388917
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 |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.74 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.74 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.7 | ![]() |
TRJ![]() | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.7 | ![]() |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.72 | ![]() |
5NS![]() | 5-aminonaphthalene-1-sulfonic acid | A,B | 3CFT | 0.71 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.89 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A | 1L4L | 0.89 | ![]() |
PHZ![]() | 1-PHENYLHYDRAZINE | A | 2E2T | 0.72 | ![]() |
PHZ![]() | 1-PHENYLHYDRAZINE | D,H | 2AGL | 0.72 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A,B | 2BDG | 0.77 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A | 1RFN | 0.77 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 2BDI | 0.77 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A,B,C,D | 2BDH | 0.77 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A | 1FIZ | 0.77 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | A | 1FIW | 0.77 | ![]() |
PBZ![]() | P-AMINO BENZAMIDINE | H,L,T | 2A2Q | 0.77 | ![]() |
5BM![]() | (2Z)-bis{amino[(2-aminophenyl)sulfanyl]methylidene}butanedinitrile | A | 3EQH | 0.71 | ![]() |
BRN![]() | BERENIL | A,B | 268D | 0.71 | ![]() |
BRN![]() | BERENIL | A,B | 1D63 | 0.71 | ![]() |
BRN![]() | BERENIL | A,D,E | 2GBY | 0.71 | ![]() |
BRN![]() | BERENIL | A | 2DBE | 0.71 | ![]() |
BRN![]() | BERENIL | A | 2GVR | 0.71 | ![]() |
U12![]() | 5-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG2 | 0.72 | ![]() |
AU4![]() | 4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE) | A | 2PYZ | 0.72 | ![]() |
2CM![]() | 2-CHLORO-6-METHYL-ANILINE | A | 1OVH | 0.74 | ![]() |
PO0![]() | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.71 | ![]() |
PO0![]() | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.71 | ![]() |
DBP![]() | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.84 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.71 | ![]() |
34A![]() | 3,4-DIMETHYLANILINE | A | 1L4K | 0.91 | ![]() |
UA5![]() | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.8 | ![]() |
APB![]() | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.74 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.73 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.73 | ![]() |
1AN![]() | 2-FLUOROANILINE | A | 1LGW | 0.73 | ![]() |
TNL![]() | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.7 | ![]() |
TFM![]() | S-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREA | A,B | 1K2U | 0.71 | ![]() |
IDM![]() | INDOLINE | A,B | 3CEP | 0.73 | ![]() |
IDM![]() | INDOLINE | A | 1AEK | 0.73 | ![]() |
IS2![]() | [(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID | A | 1O4J | 0.71 | ![]() |
ASR![]() | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.74 | ![]() |
9AP![]() | 9-AMINOPHENANTHRENE | A | 1EGY | 0.79 | ![]() |
FLM![]() | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.84 | ![]() |
ANL![]() | ANILINE | A | 2OV4 | 0.76 | ![]() |
ANL![]() | ANILINE | A | 1AEE | 0.76 | ![]() |
ANL![]() | ANILINE | A | 1PPA | 0.76 | ![]() |
ANL![]() | ANILINE | A | 1HJ9 | 0.76 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.71 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.71 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.71 | ![]() |
FRD![]() | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.71 | ![]() |
U19![]() | 5-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)- 5H-PYRAZOL-3-YLAMINE | A | 2GG5 | 0.72 | ![]() |
ANC![]() | ANTHRACEN-1-YLAMINE | A,B | 1GT1 | 0.8 | ![]() |
ANC![]() | ANTHRACEN-1-YLAMINE | A,B | 1HN2 | 0.8 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A | 1BMA | 0.87 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.87 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.87 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.87 | ![]() |
AFF![]() | 2-ACETYLAMINOFLUORENE-3-YL | A | 2GE2 | 0.72 | ![]() |
150![]() | 4,5-DIMETHYL-1,2-PHENYLENEDIAMINE | A | 1L4F | 0.88 | ![]() |
B2Y![]() | 1-biphenyl-2-ylmethanamine | A,B,C,D | 3CCB | 0.71 | ![]() |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.9 | ![]() |
N2M![]() | 5-AMINO-NAPHTALENE-2-MONOSULFONATE | C,D | 1HKN | 0.71 | ![]() |
5AN![]() | 3,5-DIFLUOROANILINE | A | 1LGX | 0.71 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELE | 0.79 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 7EST | 0.79 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 2EST | 0.79 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELD | 0.79 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QJU | 0.71 | ![]() |
DSM![]() | 3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN- 5-YL)-N-METHYLPROPAN-1-AMINE | A | 2QB4 | 0.71 | ![]() |
SBN![]() | 2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILE | A | 1JLQ | 0.73 | ![]() |