Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00003253
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 |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.74 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.74 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.74 | ![]() |
DHY![]() | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.74 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2F8D | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1A8U | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1REE | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1L7Q | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1I69 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUL | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 3CCF | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1W9Q | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,G,J | 2DU8 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUA | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H | 1H4O | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RU9 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 2V32 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2QMQ | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1UKB | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1RED | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1OC3 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1REF | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2O02 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2VJ1 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C | 1WSP | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1HZ4 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q38 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1UUJ | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2QL8 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q0I | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1S8F | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | D,E,F,G,H | 1DJR | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H,I | 1ONI | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1I7Q | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 2RHM | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2F78 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2VL2 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1HD2 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1JU4 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 2AJY | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C | 3GV1 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q6U | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1VE9 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1S9A | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L,M | 1OP3 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1W9E | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 2V2G | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 2AK1 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H | 2V41 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1GYX | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1V1T | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1YAJ | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1HKQ | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUK | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q1B | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUM | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2F7A | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H | 1KIF | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2V7B | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H | 1NCW | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1TMX | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1URM | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1W9O | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1GXS | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | H | 1RUP | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1KQB | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q9R | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | D,H | 2OK6 | 0.75 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2Q0J | 0.75 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.78 | ![]() |
3HB![]() | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.78 | ![]() |
DBE![]() | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.76 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZFK | 0.74 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZFQ | 0.74 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1Z9Y | 0.74 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZH9 | 0.74 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZGE | 0.74 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZGF | 0.74 | ![]() |
34D![]() | 3,5-DIHYDROXYBENZOATE | A,B | 2BX7 | 0.77 | ![]() |
4MA![]() | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3CMP | 0.71 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MD9 | 0.71 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MDB | 0.71 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 1L6M | 0.71 | ![]() |
DBH![]() | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3BY0 | 0.71 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.75 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.75 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.75 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.75 | ![]() |
4HP![]() | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.75 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.71 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.71 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.77 | ![]() |
AC6![]() | P-HYDROXYACETOPHENONE | X | 2O48 | 0.77 | ![]() |
4CB![]() | 4-CARBOXYPHENYLBORONIC ACID | A,B | 1KDW | 0.74 | ![]() |
CHB![]() | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.77 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.79 | ![]() |
DHB![]() | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.79 | ![]() |
3HP![]() | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.77 | ![]() |
2HC![]() | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.72 | ![]() |
789![]() | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.73 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.76 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.76 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.76 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.76 | ![]() |
ANN![]() | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.76 | ![]() |
DBY![]() | 3,5 DIBROMOTYROSINE | C,D | 1EBA | 0.77 | ![]() |
B3I![]() | 2,3,5-TRIIODOBENZOIC ACID | A | 1BKE | 0.73 | ![]() |