Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00010652
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 |
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 | ![]() |
DBP![]() | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.72 | ![]() |
DPZ![]() | 3,5-DIAMINOPHTHALHYDRAZIDE | A | 1F3E | 0.7 | ![]() |
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 | ![]() |
4AN![]() | 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3- DIONE | A | 2PAX | 0.71 | ![]() |
BVA![]() | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.72 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELE | 0.74 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 7EST | 0.74 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 2EST | 0.74 | ![]() |
ANI![]() | 4-TRIFLUOROMETHYLANILINE | E,I | 1ELD | 0.74 | ![]() |
4PG![]() | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.73 | ![]() |
4MB![]() | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.71 | ![]() |
NID![]() | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.72 | ![]() |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.73 | ![]() |
34A![]() | 3,4-DIMETHYLANILINE | A | 1L4K | 0.72 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A | 1BMA | 0.72 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.72 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.72 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.72 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.72 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A | 1L4L | 0.72 | ![]() |
AHC![]() | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.75 | ![]() |
UA5![]() | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.7 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B | 1T64 | 0.74 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B | 1C3R | 0.74 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B,C | 3F0R | 0.74 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B,C | 3C10 | 0.74 | ![]() |
IBR![]() | A | 9EST | 0.77 | ![]() | |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.87 | ![]() |
HBX![]() | benzaldehyde | A,B | 3GDN | 0.73 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A | 1C0I | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.74 | ![]() |
BE2![]() | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.74 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1PBD | 0.78 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | B | 2DZA | 0.78 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1IUS | 0.78 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1IUU | 0.78 | ![]() |
PAB![]() | 4-AMINOBENZOIC ACID | A | 1IUT | 0.78 | ![]() |
4NB![]() | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.7 | ![]() |
FLM![]() | 3-FLUORO-2-METHYL-ANILINE | A | 1OVJ | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1OB2 | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDG | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDK | 0.72 | ![]() |
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 | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | P | 3SGA | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | A,B,C,D,E,F | 1OB5 | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDM | 0.72 | ![]() |
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 | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KDV | 0.72 | ![]() |
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 | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KDY | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 3FIC | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | V,Y,Z | 2WDH | 0.72 | ![]() |
PHA![]() | PHENYLALANINAL | A,B | 1KE2 | 0.72 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.75 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.75 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.75 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A | 3FHB | 0.75 | ![]() |
ISN![]() | ISATIN | A,B | 1OJA | 0.71 | ![]() |
ISN![]() | ISATIN | A,B | 2BK5 | 0.71 | ![]() |
APZ![]() | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.76 | ![]() |
KY1![]() | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.74 | ![]() |