Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02292217
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 |
ST3 | 4-(ACETYLAMINO)-3-AMINO BENZOIC ACID | A,B | 1IVE | 0.79 |  |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3F06 | 0.71 | |
| B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZP | 0.71 | |
| B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 3EW8 | 0.71 | |
| B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZT | 0.71 | |
| B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 1T67 | 0.71 | |
UC3 | 1-METHYL ETHYL 2-CHLORO-5-[[[(1- METHYLETHOXY)THIOOXO]METHYL]AMINO]- BENZOATE | A | 1RT6 | 0.75 | |
RAC | 4-(2-DIMETHYLCARBAMOYL-PHENYLCARBAMOYLOXYMETHYL)- BENZOIC ACID | H | 1MEX | 0.74 | |
RA2 | 1-[4-CARBOXY-2-(3-PENTYLAMINO)PHENYL]- 5,5'-DI(HYDROXYMETHYL)PYRROLIDIN- 2-ONE | A | 1B9V | 0.72 | |
IBR | A | 9EST | 0.71 | | |
11B | (5R,6S,8S)-8-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 6-HYDROXY-3-OXO-5-PENTYL-1-PHENYL- 2,7-DIOXA-4-AZA-6-PHOSPHANONAN- 9-OIC ACID 6-OXIDE | A,B,C | 2PJ5 | 0.75 | |
4PG | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.75 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.8 | |
| XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.8 | |
ST6 | 4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID | A,B | 1INH | 0.77 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.71 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.71 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.72 | |
414 | (5R,6R,8S)-8-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 5-CYCLOHEXYL-6-HYDROXY-3-OXO-1- PHENYL-2,7-DIOXA-4-AZA-6-PHOSPHANONAN- 9-OIC ACID 6-OXIDE | A,B | 2PJ4 | 0.73 | |
IBA | 4-[(2R)-2-(AMINOMETHYL)-2-(HYDROXYMETHYL)- 5-OXOPYRROLIDIN-1-YL]-3-[(1-ETHYLPROPYL)AMINO]BENZOIC ACID | A | 1VCJ | 0.72 | |
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.72 | |
ST5 | 4-(ACETYLAMINO)-3-[(HYDROXYACETYL)AMINO]BENZOIC ACID | A,B | 1ING | 0.78 | |
OFL | O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID | A | 1DVZ | 0.73 | |
ST4 | 4-(ACETYLAMINO)-3-GUANIDINOBENZOIC ACID | A | 1INF | 0.8 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.72 | |
| GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.72 | |
| GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.72 | |
| GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.72 | |
86A | (2S)-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL){[(S)- HYDROXY{(1R)-2-METHYL-1-[(3-PHENYLPROPANOYL)AMINO]PROPYL}PHOSPHORYL]OXY}ACETIC ACID | A,B,C | 2PJ3 | 0.72 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.73 | |
U14 | 3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID | A | 2GG7 | 0.72 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.83 | |
| TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.83 | |
| TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.83 | |
GBS | 4-GUANIDINOBENZOIC ACID | X | 2AH4 | 0.91 | |
| GBS | 4-GUANIDINOBENZOIC ACID | A | 1GBT | 0.91 | |
| GBS | 4-GUANIDINOBENZOIC ACID | A | 1RTK | 0.91 | |
| GBS | 4-GUANIDINOBENZOIC ACID | A | 3DFL | 0.91 | |
GIS | ETHYL-(2-CARBOXY-4-GUANIDINIUM- PHENYL)-CHLOROACETATE | E | 8EST | 0.8 | |
606 | (2S)-2-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 3-[(S)-HYDROXY(3-PHENYLPROPYL)PHOSPHORYL]PROPANOIC ACID | A,B,C | 2PIZ | 0.75 | |
A80 | N-(5,5,8,8-TETRAMETHYL-5,8-DIHYDRO- NAPHTHALEN-2-YL)-TEREPHTHALAMIC ACID | A | 2CBR | 0.7 | |
L98 | (2R)-2-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 3-SULFANYLPROPANOIC ACID | A,B,C | 1ZG8 | 0.79 | |
922 | (5R,6S,8S)-8-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 6-HYDROXY-5-ISOPROPYL-3-OXO-1-PHENYL- 2,7-DIOXA-4-AZA-6-PHOSPHANONAN- 9-OIC ACID 6-OXIDE | A,B,C | 2PJ0 | 0.74 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.7 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.72 | |
| FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.72 | |
| FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.72 | |
1JZ | 1-[4-(hydroxymethyl)phenyl]guanidine | B | 3FVF | 0.79 | |
FDI | 4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID | A | 1B9S | 0.78 | |
OBA | 2-(OXALYL-AMINO)-BENZOIC ACID | A | 1C85 | 0.71 | |
33Z | (2S)-2-(3-{[AMINO(IMINO)METHYL]AMINO}PHENYL)- 3-[(R)-[(1R)-1-({N-[(BENZYLOXY)CARBONYL]- L-PHENYLALANYL}AMINO)-2-METHYLPROPYL](HYDROXY)PHOSPHORYL]PROPANOIC ACID | A,B,C | 2PJA | 0.72 | |
RAI | 1-(4-CARBOXY-2-GUANIDINOPENTYL)- 5,5'-DI(HYDROXYMETHYL)PYRROLIDIN- 2-ONE | A | 1B9T | 0.79 | |
P20 | 2-(5-{[AMINO(IMINO)METHYL]AMINO}- 2-CHLOROPHENYL)-3-SULFANYLPROPANOIC ACID | A,B,C | 1ZG7 | 0.73 | |
AAF | METHYL 4-{[({[(2R,5S)-5-{[(2S)- 2-(AMINOMETHYL)PYRROLIDIN-1-YL]CARBONYL}PYRROLIDIN- 2-YL]METHYL}AMINO)CARBONYL]AMINO}BENZOATE | B | 2G63 | 0.8 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.75 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.77 | |
| PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.77 | |
| PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.77 | |
| PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.77 | |
| PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.77 | |