Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03098861
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 |
XYD![]() | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.73 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A | 1L4L | 0.73 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.75 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A | 1HSR | 0.75 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.75 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.75 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.75 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A | 3GCK | 0.75 | ![]() |
BHO![]() | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.75 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A | 1C0I | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.79 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.79 | ![]() |
KY1![]() | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.79 | ![]() |
SX3![]() | 4-bromo-2-{[(3R,5S)-3,5-dimethylpiperidin- 1-yl]carbonyl}aniline | A,B | 3CJ2 | 0.71 | ![]() |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.86 | ![]() |
NID![]() | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.73 | ![]() |
OCH![]() | QUINOLIN-2(1H)-ONE | A,B,C,D,E,F | 1Z03 | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1OB2 | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDG | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDK | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | 1,2,4,5,A,B, C,D,E,J,K,L, M,N,O,P,R,S, T,U,V,Z | 1M90 | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | P | 3SGA | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | A,B,C,D,E,F | 1OB5 | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDM | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | 0,2,4,9,A,B, C,H,I,J,K,L, M,N,P,Q,R,S, T,X,Y,Z | 1KQS | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KDV | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | 1,2,4,5,6,A, B,C,D,E,J,K, L,M,N,O,P,R, S,T,U,V,Z | 1Q86 | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KDY | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 3FIC | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDH | 0.71 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KE2 | 0.71 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELE | 0.72 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 7EST | 0.72 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 2EST | 0.72 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELD | 0.72 | ![]() |
AHC![]() | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.73 | ![]() |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.74 | ![]() |
DPZ![]() | 3,5-DIAMINOPHTHALHYDRAZIDE | A | 1F3E | 0.71 | ![]() |
BVA![]() | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.71 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1PBD | 0.73 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | B | 2DZA | 0.73 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1IUS | 0.73 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1IUU | 0.73 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1IUT | 0.73 | ![]() |
FLM![]() | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.73 | ![]() |
DBP![]() | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | ![]() |
AQO![]() | 2-AMINOQUINAZOLIN-4(3H)-ONE | A | 1S39 | 0.75 | ![]() |
HBX![]() | benzaldehyde | A,B | 3GDN | 0.73 | ![]() |
KYN![]() | KYNURENINE | A,B,C,D | 2R2N | 0.75 | ![]() |
KYN![]() | KYNURENINE | A,B | 3E2Z | 0.75 | ![]() |
KYN![]() | KYNURENINE | A | 1XT7 | 0.75 | ![]() |
KYN![]() | KYNURENINE | A | 1T5M | 0.75 | ![]() |
KYN![]() | KYNURENINE | A | 1T5N | 0.75 | ![]() |
KYN![]() | KYNURENINE | A | 2VOV | 0.75 | ![]() |
KYN![]() | KYNURENINE | A | 2VOX | 0.75 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.74 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.74 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.74 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A | 3FHB | 0.74 | ![]() |
IBR![]() | A | 9EST | 0.75 | ![]() | |
ISN![]() | ISATIN | A,B | 1OJA | 0.76 | ![]() |
ISN![]() | ISATIN | A,B | 2BK5 | 0.76 | ![]() |
4PG![]() | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.71 | ![]() |
SX1![]() | 2-amino-5-bromobenzoic acid | A,B | 3CIZ | 0.72 | ![]() |
APZ![]() | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.71 | ![]() |