Reaction Details Report a problem with these data
Target
C-C chemokine receptor type 1
Ligand
BDBM50208997
Substrate
n/a
Meas. Tech.
ChEMBL_443413 (CHEMBL893666)
IC50
480±n/a nM
Citation
 Brown, MF; Bahnck, KB; Blumberg, LC; Brissette, WH; Burrell, SA; Driscoll, JP; Fedeles, F; Fisher, MB; Foti, RS; Gladue, RP; Guzman-Martinez, A; Hayward, MM; Lira, PD; Lillie, BM; Lu, Y; Lundquist, GD; McElroy, EB; McGlynn, MA; Paradis, TJ; Poss, CS; Roache, JH; Shavnya, A; Shepard, RM; Trevena, KA; Tylaska, LA Piperazinyl CCR1 antagonists--optimization of human liver microsome stability. Bioorg Med Chem Lett 17:3109-12 (2007) [PubMed]  Article 
Target
Name:
C-C chemokine receptor type 1
Synonyms:
C-C CKR-1 | C-C chemokine receptor type 1 (CCR1) | CC-CKR-1 | CCR-1 | CCR1 | CCR1_HUMAN | CD_antigen=CD191 | CMKBR1 | CMKR1 | HM145 | LD78 receptor | MIP-1alpha-R | Macrophage inflammatory protein 1-alpha receptor | RANTES-R | SCYAR1
Type:
Enzyme
Mol. Mass.:
41180.69
Organism:
Homo sapiens (Human)
Description:
P32246
Residue:
355
Sequence:
METPNTTEDYDTTTEFDYGDATPCQKVNERAFGAQLLPPLYSLVFVIGLVGNILVVLVLVQYKRLKNMTSIYLLNLAISDLLFLFTLPFWIDYKLKDDWVFGDAMCKILSGFYYTGLYSEIFFIILLTIDRYLAIVHAVFALRARTVTFGVITSIIIWALAILASMPGLYFSKTQWEFTHHTCSLHFPHESLREWKLFQALKLNLFGLVLPLLVMIICYTGIIKILLRRPNEKKSKAVRLIFVIMIIFFLFWTPYNLTILISVFQDFLFTHECEQSRHLDLAVQVTEVIAYTHCCVNPVIYAFVGERFRKYLRQLFHRRVAVHLVKWLPFLSVDRLERVSSTSPSTGEHELSAGF
  
Inhibitor
Name:
BDBM50208997
Synonyms:
CHEMBL234606 | N-((2S,3S,5R)-5-(aminomethyl)-1-(3-fluorophenyl)-3,8-dihydroxy-8-methylnonan-2-yl)quinoxaline-2-carboxamide
Type:
Small organic molecule
Emp. Form.:
C26H33FN4O3
Mol. Mass.:
468.5636
SMILES:
CC(C)(O)CC[C@@H](CN)C[C@H](O)[C@H](Cc1cccc(F)c1)NC(=O)c1cnc2ccccc2n1
Structure:
Search PDB for entries with ligand similarity: