Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01072280
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 |
CPM![]() | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.77 | ![]() |
C0E![]() | 3-fluoro-6-(4-fluorophenyl)-2-hydroxy- 6-oxohexa-2,4-dienoic acid | A | 2RHW | 0.76 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.73 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.73 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.73 | ![]() |
BZQ![]() | DIPHENYLMETHANONE | A,B | 1GT5 | 0.8 | ![]() |
BZQ![]() | DIPHENYLMETHANONE | A,B | 1DZP | 0.8 | ![]() |
173![]() | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.78 | ![]() |
5PV![]() | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.73 | ![]() |
BCS![]() | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.71 | ![]() |
BCS![]() | BENZYLCYSTEINE | A | 1EH8 | 0.71 | ![]() |
4MA![]() | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | ![]() |
9TA![]() | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.75 | ![]() |
BTP![]() | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.77 | ![]() |
4CB![]() | 4-CARBOXYPHENYLBORONIC ACID | A,B | 1KDW | 0.71 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.71 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.71 | ![]() |
ANQ![]() | ACENAPHTHENEQUINONE | H,J | 1OAX | 0.7 | ![]() |
256![]() | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.73 | ![]() |
3PL![]() | 3-PHENYLPROPANAL | E | 1Y3G | 0.7 | ![]() |
CS4![]() | S-[3-(3,4-DICHLOROPHENYL)-3-OXOPROPYL]- L-CYSTEINE | A | 2OQZ | 0.73 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2F8D | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1A8U | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1REE | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1L7Q | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1I69 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUL | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 3CCF | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1W9Q | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,G,J | 2DU8 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUA | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H | 1H4O | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RU9 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 2V32 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2QMQ | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1UKB | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1RED | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1OC3 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1REF | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2O02 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2VJ1 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C | 1WSP | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1HZ4 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q38 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1UUJ | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2QL8 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q0I | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1S8F | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | D,E,F,G,H | 1DJR | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H,I | 1ONI | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1I7Q | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 2RHM | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2F78 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2VL2 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1HD2 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1JU4 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 2AJY | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C | 3GV1 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q6U | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1VE9 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1S9A | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L,M | 1OP3 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1W9E | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 2V2G | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 2AK1 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H | 2V41 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1GYX | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1V1T | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1YAJ | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1HKQ | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUK | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q1B | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H,L | 1RUM | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2F7A | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D,E,F, G,H | 1KIF | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2V7B | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H | 1NCW | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 1TMX | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1URM | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 1W9O | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1GXS | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | H | 1RUP | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B,C,D | 1KQB | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A | 2Q9R | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | D,H | 2OK6 | 0.71 | ![]() |
BEZ![]() | BENZOIC ACID | A,B | 2Q0J | 0.71 | ![]() |
C1E![]() | (2Z,4E)-3-chloro-2-hydroxy-6-oxo- 6-phenylhexa-2,4-dienoic acid | A | 2RHT | 0.77 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZFK | 0.71 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZFQ | 0.71 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1Z9Y | 0.71 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZH9 | 0.71 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZGE | 0.71 | ![]() |
BE7![]() | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZGF | 0.71 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK1 | 0.82 | ![]() |
AC0![]() | 1-PHENYLETHANONE | A | 1ZK4 | 0.82 | ![]() |