PDB ligand accession: PV9
DrugBank: DB08860
InChI Key: VGYFMXBACGZSIL-MCBHFWOFSA-N
SMILES: c1ccc2c(c1)c(c(c(n2)C3CC3)C=CC(CC(CC(=O)O)O)O)c4ccc(cc4)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Phenylquinolines
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P20701 | Download | Predicted | P20701_F1_nD1 P20701_F1_nD3 P20701_F1_nD4 P20701_F1_nD2 | HAD domain-related Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich beta-propeller-like |
1CQP | Predicted | e1cqpB1 e1cqpA1 | ||
1DGQ | Predicted | e1dgqA1 | ||
1LFA | Predicted | e1lfaA1 e1lfaB1 | ||
1MJN | Predicted | e1mjnA1 | ||
1MQ8 | Predicted | e1mq8D1 e1mq8B1 | ||
1MQ9 | Predicted | e1mq9A1 | ||
1MQA | Predicted | e1mqaA1 | ||
1RD4 | Predicted | e1rd4C1 e1rd4D1 e1rd4A1 e1rd4B1 | ||
1T0P | Predicted | e1t0pA1 | ||
1XDD | Predicted | e1xddB1 e1xddA1 | ||
1XDG | Predicted | e1xdgB1 e1xdgA1 | ||
1XUO | Predicted | e1xuoB1 e1xuoA1 | ||
1ZON | Predicted | e1zonA1 | ||
1ZOO | Predicted | e1zooB1 e1zooA1 | ||
1ZOP | Predicted | e1zopB1 e1zopA1 | ||
2ICA | Predicted | e2icaA1 | ||
2K8O | Predicted | e2k8oA1 | ||
2O7N | Predicted | e2o7nA1 | ||
3BN3 | Predicted | e3bn3A1 | ||
3BQM | Predicted | e3bqmC1 e3bqmB1 | ||
3BQN | Predicted | e3bqnC1 e3bqnB1 | ||
3E2M | Predicted | e3e2mA1 e3e2mB1 | ||
3EOA | Predicted | e3eoaI1 e3eoaJ1 | ||
3EOB | Predicted | e3eobI1 e3eobJ1 | ||
3F74 | Predicted | e3f74A1 e3f74B1 e3f74C1 | ||
3F78 | Predicted | e3f78A1 e3f78B1 e3f78C1 | ||
3HI6 | Predicted | e3hi6A1 e3hi6B1 | ||
3M6F | Predicted | e3m6fA1 | ||
3TCX | Predicted | e3tcxB1 e3tcxD1 e3tcxF1 e3tcxH1 e3tcxJ1 e3tcxL1 e3tcxN1 e3tcxP1 e3tcxR1 e3tcxT1 e3tcxV1 e3tcxX1 e3tcxZ1 e3tcxb1 | ||
4IXD | Predicted | e4ixdA1 | ||
5E6R | Predicted | e5e6rA2 e5e6rA1 | ||
5E6S | Predicted | e5e6sA2 e5e6sC2 e5e6sE2 e5e6sA1 e5e6sC1 e5e6sE1 | ||
5E6U | Predicted | e5e6uA2 e5e6uA1 | ||
6BXB | Predicted | e6bxbB2 e6bxbA3 | ||
6BXF | Predicted | e6bxfA5 e6bxfB1 | ||
6BXJ | Predicted | e6bxjA7 |