Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02414761
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 |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.7 | ![]() |
EBW![]() | 4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}- 3-OXOPENTYL)-N,N-DIMETHYL-N-PROP- 2-ENYLBENZENAMINIUM | A | 1E3Q | 0.73 | ![]() |
BOS![]() | N-[4-(AMINOSULFONYL)PHENYL]-2-MERCAPTOBENZAMIDE | A | 2HD6 | 0.7 | ![]() |
CRI![]() | A,B | 1VKG | 0.73 | ![]() | |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.71 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.71 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.71 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A | 3FHB | 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 | ![]() |
AO2![]() | N'-(2S,3R)-3-AMINO-4-CYCLOHEXYL- 2-HYDROXY-BUTANO-N-(4-METHYLPHENYL)HYDRAZIDE | A | 1R5H | 0.71 | ![]() |
537![]() | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 1UKI | 0.72 | ![]() |
537![]() | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 1PMV | 0.72 | ![]() |
537![]() | 2,6-DIHYDROANTHRA/1,9-CD/PYRAZOL- 6-ONE | A | 2ZMD | 0.72 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A,B | 3GEY | 0.7 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A | 3CE0 | 0.7 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A,B | 1XK9 | 0.7 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A | 2Q6M | 0.7 | ![]() |
P34![]() | N~2~,N~2~-DIMETHYL-N~1~-(6-OXO- 5,6-DIHYDROPHENANTHRIDIN-2-YL)GLYCINAMIDE | A,B,C,D,E,F | 1ZM9 | 0.7 | ![]() |
NID![]() | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.75 | ![]() |
4PG![]() | 1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine | U | 2R2W | 0.77 | ![]() |
EAB![]() | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.72 | ![]() |
DPZ![]() | 3,5-DIAMINOPHTHALHYDRAZIDE | A | 1F3E | 0.75 | ![]() |
ISN![]() | ISATIN | A,B | 1OJA | 0.72 | ![]() |
ISN![]() | ISATIN | A,B | 2BK5 | 0.72 | ![]() |
34A![]() | 3,4-DIMETHYLANILINE | A | 1L4K | 0.7 | ![]() |
ZAB![]() | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.72 | ![]() |
ZAB![]() | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.72 | ![]() |
GIN![]() | 2-{[(6-OXO-1,6-DIHYDROPYRIDIN-3- YL)METHYL]AMINO}-N-[4-PROPYL-3- (TRIFLUOROMETHYL)PHENYL]BENZAMIDE | A,B | 2HZ0 | 0.7 | ![]() |
IBR![]() | A | 9EST | 0.7 | ![]() | |
4AN![]() | 6-AMINO-BENZO[DE]ISOQUINOLINE-1,3- DIONE | A | 2PAX | 0.72 | ![]() |
12B![]() | BENZO[CD]INDOL-2(1H)-ONE | A,B | 2F67 | 0.71 | ![]() |
APZ![]() | 4-AMINOPHTHALHYDRAZIDE | A | 1ENU | 0.8 | ![]() |
KYN![]() | KYNURENINE | A,B,C,D | 2R2N | 0.72 | ![]() |
KYN![]() | KYNURENINE | A,B | 3E2Z | 0.72 | ![]() |
KYN![]() | KYNURENINE | A | 1XT7 | 0.72 | ![]() |
KYN![]() | KYNURENINE | A | 1T5M | 0.72 | ![]() |
KYN![]() | KYNURENINE | A | 1T5N | 0.72 | ![]() |
KYN![]() | KYNURENINE | A | 2VOV | 0.72 | ![]() |
KYN![]() | KYNURENINE | A | 2VOX | 0.72 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B | 1T64 | 0.75 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B | 1C3R | 0.75 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B,C | 3F0R | 0.75 | ![]() |
TSN![]() | TRICHOSTATIN A | A,B,C | 3C10 | 0.75 | ![]() |
HBC![]() | (2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT- 2-YL)-PHENYL-METHANONE | H | 1JGU | 0.71 | ![]() |
AHC![]() | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.71 | ![]() |
U1N![]() | 4-[(3R)-3-{[2-(4-FLUOROPHENYL)- 2-OXOETHYL]AMINO}BUTYL]BENZAMIDE | A,B | 2OGZ | 0.71 | ![]() |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.83 | ![]() |
TTT![]() | 5-amino-2-methyl-N-[(1R)-1-naphthalen- 1-ylethyl]benzamide | A | 3E9S | 0.73 | ![]() |
AN9![]() | 1,5-BIS[3-(DIETHYLAMINO)PROPIONAMIDO]ANTHRACENE- 9,10-DIONE | A,B | 1XCU | 0.73 | ![]() |
UN6![]() | (3-{[3-(3-SULFOAMINO-PHENYL)-PROPIONYLAMINO]- METHYL}-PHENYL)-SULFAMIC ACID | A | 2F70 | 0.71 | ![]() |
666![]() | 6-(4-{[2-(3-IODOBENZYL)-3-OXOCYCLOHEX- 1-EN-1-YL]AMINO}PHENYL)-5-METHYL- 4,5-DIHYDROPYRIDAZIN-3(2H)-ONE | A,B,C,D | 1SO2 | 0.7 | ![]() |
KY1![]() | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.74 | ![]() |