Ki Summary

Reaction Details

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Target

Corticotropin-releasing factor-binding protein

Ligand

BDBM91366

Substrate/Competitor

n/a

IC50

1330±n/a nM

Citation

PubChem, PC Dose Response confirmation of uHTS hits for small molecule antagonists of the CRF-binding protein and CRF-R2 receptor complex in 384 well format PubChem Bioassay(2012)[AID]

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Corticotropin-releasing factor-binding protein

Name:

Corticotropin-releasing factor-binding protein

Synonyms:

CRFBP | CRHBP | CRHBP_HUMAN | corticotropin releasing factor-binding protein

Type:

Enzyme Catalytic Domain

Mol. Mass.:

36143.95

Organism:

Homo sapiens (Human)

Description:

P24387

Residue:

322

Sequence:

MSPNFKLQCHFILIFLTALRGESRYLELREAADYDPFLLFSANLKRELAGEQPYRRALRC
LDMLSLQGQFTFTADRPQLHCAAFFISEPEEFITIHYDQVSIDCQGGDFLKVFDGWILKG
EKFPSSQDHPLPSAERYIDFCESGLSRRSIRSSQNVAMIFFRVHEPGNGFTLTIKTDPNL
FPCNVISQTPNGKFTLVVPHQHRNCSFSIIYPVVIKISDLTLGHVNGLQLKKSSAGCEGI
GDFVELLGGTGLDPSKMTPLADLCYPFHGPAQMKVGCDNTVVRMVSSGKHVNRVTFEYRQ
LEPYELENPNGNSIGEFCLSGL

BDBM91366

n/a

Name

BDBM91366

Synonyms:

(1S,12bS)-3-[2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-keto-ethyl]-N,N-diethyl-4-keto-9-methoxy-12b-methyl-1,2,3,6,7,12-hexahydropyrido[2,1-a]-carboline-1-carboxamide | (1S,12bS)-3-[2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-oxidanylidene-ethyl]-N,N-diethyl-9-methoxy-12b-methyl-4-oxidanylidene-1,2,3,6,7,12-hexahydroindolo[2,3-a]quinolizine-1-carboxamide | (1S,12bS)-3-[2-[[(2E)-3,7-dimethylocta-2,6-dienyl]amino]-2-oxoethyl]-N,N-diethyl-9-methoxy-12b-methyl-4-oxo-1,2,3,6,7,12-hexahydroindolo[2,3-a]quinolizine-1-carboxamide | MLS002608821 | SMR001530050 | cid_44601757

Type

Small organic molecule

Emp. Form.

C34H48N4O4

Mol. Mass.

576.7693

SMILES

CCN(CC)C(=O)[C@H]1CC(CC(=O)NC\C=C(/C)CCC=C(C)C)C(=O)N2CCc3c([nH]c4ccc(OC)cc34)[C@]12C |wD:40.44,7.6,(13.59,-2.49,;13.13,-1.02,;11.63,-.68,;10.58,-1.81,;11.04,-3.28,;11.17,.79,;9.67,1.13,;12.21,1.92,;13.78,1.58,;14.85,2.77,;16.36,2.46,;16.84,.99,;15.81,-.16,;18.35,.68,;18.83,-.78,;20.34,-1.1,;20.82,-2.56,;19.79,-3.71,;22.33,-2.88,;22.81,-4.34,;24.32,-4.65,;24.8,-6.12,;26.3,-6.43,;23.77,-7.26,;14.34,4.29,;15.36,5.45,;12.77,4.6,;12.29,6.07,;10.79,6.39,;9.76,5.24,;10.23,3.78,;8.99,2.88,;7.75,3.78,;6.2,3.42,;5.12,4.6,;5.61,6.12,;4.59,7.26,;3.08,6.95,;7.18,6.44,;8.23,5.24,;11.74,3.46,;10.71,2.31,)|

Structure