Bioactive Compound Details
Compound ID: | B094078 |
Source ID: | CHEMBL1732 |
Source Type: | Small molecule |
Compound Name: | DIHYDROERGOTAMINE |
Synonyms: | 9,10-DIHYDROERGOTAMINE|DIHYDROERGOTAMINE|Dihydroergotamine|MAP-0004|MAP0004|NEOMIGRAN |
Molecular Formula: | C33H37N5O5 |
SMILES: | CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 |
Molecular Species: | NEUTRAL |

Target ID | Target Name | GENE | Action | Class | UniProtKB ID | Entry Name | |
---|---|---|---|---|---|---|---|
T15 | 3-hydroxy-3-methylglutaryl-coenzyme A reductase | HMGCR | inhibitor | Enzyme | P04035 | HMDH_HUMAN | Details |
T10 | Caspase-1 | CASP1 | inhibitor | Enzyme | P29466 | CASP1_HUMAN | Details |
T24 | C-C chemokine receptor type 2 | CCR2 | antagonist | GPCR | P41597 | CCR2_HUMAN | Details |
T25 | C-C chemokine receptor type 5 | CCR5 | antagonist | GPCR | P51681 | CCR5_HUMAN | Details |