Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00016043
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 |
AOM | 5-ALPHA-ANDROSTANE-3-BETA,17BETA- DIOL | A | 1LHO | 0.86 |  |
TES | TESTOSTERONE | A | 1JTV | 0.78 | |
| TES | TESTOSTERONE | A | 2Q7L | 0.78 | |
| TES | TESTOSTERONE | A | 2Q7I | 0.78 | |
| TES | TESTOSTERONE | A,B | 1J96 | 0.78 | |
| TES | TESTOSTERONE | A | 2Q7K | 0.78 | |
| TES | TESTOSTERONE | A,B | 1Q13 | 0.78 | |
| TES | TESTOSTERONE | H | 1I9J | 0.78 | |
| TES | TESTOSTERONE | A,B | 1AFS | 0.78 | |
| TES | TESTOSTERONE | H | 1VPO | 0.78 | |
| TES | TESTOSTERONE | A | 2Q7J | 0.78 | |
| TES | TESTOSTERONE | A,B | 3BUR | 0.78 | |
| TES | TESTOSTERONE | A | 2AM9 | 0.78 | |
5SD | 5ALPHA-ANDROSTAN-3,17-DIONE | A | 1QYW | 0.79 | |
| 5SD | 5ALPHA-ANDROSTAN-3,17-DIONE | A,B,C | 1OHS | 0.79 | |
DHT | 5-ALPHA-DIHYDROTESTOSTERONE | L | 2PIP | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T7M | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1I38 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T74 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T7R | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PKL | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T63 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1KDK | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1DHT | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIR | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T76 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2Z4J | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T79 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIO | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIV | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2QPY | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2AMA | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T65 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIX | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1KDM | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T7T | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T5Z | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIQ | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIT | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIU | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 2PIW | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1I37 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1XJ7 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1D2S | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1F5F | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T73 | 1 | |
| DHT | 5-ALPHA-DIHYDROTESTOSTERONE | A | 1T7F | 1 | |
1CA | DESOXYCORTICOSTERONE | A,B | 1Y9R | 0.75 | |
| 1CA | DESOXYCORTICOSTERONE | A,B,C | 2ABI | 0.75 | |
| 1CA | DESOXYCORTICOSTERONE | A | 2Q3Y | 0.75 | |
| 1CA | DESOXYCORTICOSTERONE | A | 2AA7 | 0.75 | |
AS4 | ALDOSTERONE | A | 2AA2 | 0.7 | |
| AS4 | ALDOSTERONE | A | 2Q1H | 0.7 | |
HCY | (11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione | A,B | 2VDY | 0.71 | |
| HCY | (11alpha,14beta)-11,17,21-trihydroxypregn- 4-ene-3,20-dione | A | 2V95 | 0.71 | |
CAH | 5-EXO-HYDROXYCAMPHOR | A | 1NOO | 0.79 | |
ESR | ESTRADIOL | A,B,C,D | 1OHP | 0.79 | |
S5H | 5-ALPHA-PREGNANE-3-BETA-OL-HEMISUCCINATE | L | 2DBL | 0.85 | |
CAX | (2S,4S)-4-(2,2-DIHYDROXYETHYL)- 2,3,3-TRIMETHYLCYCLOPENTANONE | A,B,C,D,E,F, G,H,I,J,K,L | 1SZO | 0.74 | |
PLO | (3BETA)-3-HYDROXYPREGN-5-EN-20- ONE | A | 1Q20 | 0.77 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPG | 0.78 | |
| FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPJ | 0.78 | |
| FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPF | 0.78 | |
BDT | 5-beta-DIHYDROTESTOSTERONE | A,B | 3DOP | 1 | |
AE2 | AETIOCHOLANOLONE | A | 2QP4 | 1 | |
| AE2 | AETIOCHOLANOLONE | A,B | 1YB1 | 1 | |
| AE2 | AETIOCHOLANOLONE | A | 2QP3 | 1 | |
| AE2 | AETIOCHOLANOLONE | A,B | 1X8J | 1 | |
| AE2 | AETIOCHOLANOLONE | A,B,C,D | 1NFQ | 1 | |
| AE2 | AETIOCHOLANOLONE | H | 1DBJ | 1 | |
| AE2 | AETIOCHOLANOLONE | A | 1OV4 | 1 | |
C0R | CORTICOSTERONE | A | 2A3I | 0.73 | |
| C0R | CORTICOSTERONE | A,B | 1Y5R | 0.73 | |
CHC | 6-ETHYL-CHENODEOXYCHOLIC ACID | A,B | 1OT7 | 0.88 | |
| CHC | 6-ETHYL-CHENODEOXYCHOLIC ACID | A,B | 1OSV | 0.88 | |
JN3 | CHENODEOXYCHOLIC ACID | A | 2JN3 | 0.88 | |
AON | 5-ALPHA-ANDROSTANE-3-BETA,17-ALPHA- DIOL | A | 1LHN | 0.86 | |
AND | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A,B | 1E3R | 0.78 | |
| AND | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 3DHE | 0.78 | |
| AND | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1J99 | 0.78 | |
| AND | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1COY | 0.78 | |
| AND | 3-BETA-HYDROXY-5-ANDROSTEN-17-ONE | A | 1Q22 | 0.78 | |
ANO | 5-BETA-ANDROSTANE-3,17-DIONE | H,L | 2O5Z | 0.79 | |
| ANO | 5-BETA-ANDROSTANE-3,17-DIONE | H | 1DBK | 0.79 | |
IU5 | ISO-URSODEOXYCHOLIC ACID | A,B | 1IHI | 0.88 | |
| IU5 | ISO-URSODEOXYCHOLIC ACID | A,B | 1OT7 | 0.88 | |
DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A,B,C,D | 1WB1 | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A,B,C,D | 1WB3 | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A | 2BJF | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A,B,C,D | 1WB2 | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A | 1FM4 | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A | 2W1B | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A,B | 1E3V | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A | 1OS6 | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A,B,C,D | 3DTU | 0.91 | |
| DXC | (3ALPHA,5BETA,12ALPHA)-3,12-DIHYDROXYCHOLAN- 24-OIC ACID | A | 2OPX | 0.91 | |
CHD | CHOLIC ACID | A,B | 2PNJ | 0.88 | |
| CHD | CHOLIC ACID | A,B | 1HRK | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2PO7 | 0.88 | |
| CHD | CHOLIC ACID | A | 2QO6 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,E,F,G, I,J,M,N,O,P, Q,S,T,V,W,Z | 1V55 | 0.88 | |
| CHD | CHOLIC ACID | A | 2AZY | 0.88 | |
| CHD | CHOLIC ACID | A,B,C | 2DQY | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Y,Z | 2EIN | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,F,G,I, J,L,M,N,O,P, S,T,V,W,Z | 2EIJ | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D | 2QD1 | 0.88 | |
| CHD | CHOLIC ACID | A | 2FT9 | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2HRC | 0.88 | |
| CHD | CHOLIC ACID | A,B | 1TW4 | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2QD3 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,E,F, G,I,J,L,M,N, O,P,Q,S,T,V, W,Z | 1V54 | 0.88 | |
| CHD | CHOLIC ACID | A | 2RLC | 0.88 | |
| CHD | CHOLIC ACID | A,B | 1ON5 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,F,G, J,L,M,N,O,P, S,T,W,Z | 2ZXW | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2QD4 | 0.88 | |
| CHD | CHOLIC ACID | A | 2QO5 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z | 2DYS | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2QD2 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C | 3ELZ | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2PO5 | 0.88 | |
| CHD | CHOLIC ACID | A,B | 1S9Q | 0.88 | |
| CHD | CHOLIC ACID | A,B | 1EE2 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z | 2DYR | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,F,G, I,J,L,M,N,O, P,S,T,V,W,Z | 2EIM | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D | 2HRE | 0.88 | |
| CHD | CHOLIC ACID | A,B | 2QD5 | 0.88 | |
| CHD | CHOLIC ACID | A,B | 3EM0 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,D,F,G, I,J,L,M,N,O, P,Q,S,T,V,W,Z | 2EIL | 0.88 | |
| CHD | CHOLIC ACID | A | 2QO4 | 0.88 | |
| CHD | CHOLIC ACID | A,B,C,E,F,G, I,J,L,M,N,O, P,Q,S,T,V,W, Y,Z | 2EIK | 0.88 | |
CI2 | (5BETA)-PREGNANE-3,20-DIONE | A,C,D | 1XV9 | 0.78 | |
| CI2 | (5BETA)-PREGNANE-3,20-DIONE | A,B | 3CAV | 0.78 | |