On Target NK1R_HUMAN 0.41121495/CHEMBL47070
For the given ligand chenyan1, we have found in our database that, being scored 0.41121495, the most similar ligand is CHEMBL47070. Check out the elaboration below.
| chenyan1 (Given Ligand) | CHEMBL47070 (Similar Ligand) |
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| Cc1ccc4c(c1)[nH+]c(/C=C/c2cccc3cccnc23)n4c6cccc(OCCCN5CCN(C)CC5)c6 | COc1ccccc1CN(C[C@@H](Cc2c[nH]c3ccccc23)NC(=O)COc4ccc(cc4)n5ccnc5)C(=O)C |
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| 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 | 04002002 00803a08 20100108 45810612 000412c0 00000100 0200a000 2200140c 00400980 001908c0 0834800c 4000c000 18809802 00402800 011c1641 000c200c 18000008 82000000 00600400 00020201 c0000100 38248608 33800040 93400018 00042000 c0000000 08048008 90000001 0c000300 0046000b 64040200 01000620 |