On Target MSHR_HUMAN 0.34615386/CHEMBL2112918
For the given ligand chenyan1, we have found in our database that, being scored 0.34615386, the most similar ligand is CHEMBL2112918. Check out the elaboration below.
| chenyan1 (Given Ligand) | CHEMBL2112918 (Similar Ligand) |
|---|---|
| Cc1ccc4c(c1)[nH+]c(/C=C/c2cccc3cccnc23)n4c6cccc(OCCCN5CCN(C)CC5)c6 | CCCC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@H](Cc2ccc(OCC)cc2)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(=O)NCC(=O)N |
|
|
|
|
|
|
| 04010002 80800a08 20104908 16050e10 00041064 06004000 a20080a0 08001408 00100104 000038c0 1120800c 40018000 00811802 0840a200 81060043 024c200c 08200408 02000004 00e00000 00420602 c0000000 38008038 a18000e1 83418010 00040001 c2000041 0840a040 40000200 0c418204 00460848 44040000 020002e0 | 04010002 01003a08 20100108 45810e10 04041242 00000000 02052020 2000000c 00600980 00090ac2 28308014 5003b800 1e808812 00502809 81020041 000c000c 00000800 0e000000 00200418 40020201 60000d00 38248628 21800003 93500018 00043800 80000200 48130000 10000100 0c000204 0046000b 60044200 20002620 |