On Target XCT_HUMAN 0.33840305/CHEMBL3629669
For the given ligand Methotrexate, we have found in our database that, being scored 0.33840305, the most similar ligand is CHEMBL3629669. Check out the elaboration below.
| Methotrexate (Given Ligand) | CHEMBL3629669 (Similar Ligand) |
|---|---|
| CN(Cc2cnc1nc(N)nc(N)c1n2)c3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3 | COc1ccc(CN2CCN(CC(=O)c3ccc(OC(C)C)c(-n4c(CN5CCN(C(=O)COc6ccc(Cl)cc6)CC5)nc5ccccc5c4=O)c3)CC2)cc1 |
|
|
|
|
|
|
| 1003c00a 01a05800 00180902 98090e30 0a1a10c8 0010c000 0000e000 22001801 10400100 000208c0 41210004 4000b000 06008822 02108000 008e0440 100c010c 18040000 02000000 08400000 40200201 40100000 1c068e40 23810840 0040001c 00140000 c0000001 08008000 9000008c 0000810c 00461801 e0044000 80800ac0 | 0400a002 00002a08 20500109 14310e02 800c10e0 00104120 12049802 0200b009 06500180 400908e0 0925000c 4001e800 0280b806 00603201 011634c1 120c410c 18000018 82008402 00600400 00020200 400200c1 38278738 33800061 8370001c 00142000 c0000040 28328008 80040005 0c404304 0046000b c0444000 c01266a2 |