Click here for a description of the charts and data table
Please tell us if you are using this feature and what you think!
ChEMBL ligand: CHEMBL441225 (CP-99994) |
---|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
There should be some charts here, you may need to enable JavaScript!
|
DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
---|---|---|---|---|---|---|---|---|
NK1 receptor/Neurokinin 1 receptor in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL249] [GtoPdb: 360] [UniProtKB: P25103] | ||||||||
ChEMBL | Antagonistic potency for NK-1 receptor was determined in vitro, using isolated rabbit vena cava. | F | 8.9 | pKd | 1.26 | nM | Kd | Bioorg Med Chem Lett (1997) 7: 203-208 |
ChEMBL | In vitro binding affinity for the Tachykinin receptor 1 in human IM-9 cell using [125I]BH-SP of the compound. | B | 5 | pKi | >10000 | nM | Ki | J Med Chem (1992) 35: 4911-4913 [PMID:1282570] |
ChEMBL | In vitro binding affinity towards human NK-1 receptor in IM-9 cells using [3H]SP of substance P antagonist | B | 8.82 | pKi | 1.5 | nM | Ki | Bioorg Med Chem Lett (1994) 4: 1865-1868 |
ChEMBL | Binding affinity measured by displacement of tritiated radiolabeled substance P from cloned human NK1 receptor expressed in CHO cell membranes | B | 9.1 | pKi | 0.79 | nM | Ki | Bioorg Med Chem Lett (1995) 5: 2671-2676 |
ChEMBL | In vitro binding affinity for the Tachykinin receptor 1 in human IM-9 cell using [125I]BH-SP of the compound. | B | 9.32 | pKi | 0.48 | nM | Ki | J Med Chem (1992) 35: 4911-4913 [PMID:1282570] |
ChEMBL | Compound was evaluated for binding affinity towards neurokinin NK1 receptor. | B | 9.4 | pKi | 0.4 | nM | Ki | Bioorg Med Chem Lett (1996) 6: 13-16 |
ChEMBL | Binding affinity was carried out with NK 1 receptors from U-373MG human astrocytoma cell line | B | 9.4 | pKi | 0.4 | nM | Ki | Bioorg Med Chem Lett (1996) 6: 161-164 |
ChEMBL | Binding affinity to Tachykinin receptor 1 stably expressed in chinese hamster ovary (CHO) cells | B | 9.6 | pKi | 0.25 | nM | Ki | J Med Chem (1995) 38: 4985-4992 [PMID:8544174] |
ChEMBL | In vitro binding affinity against human NK1 receptor expressed in CHO cells using [3H]-substance P as radioligand | B | 9.6 | pKi | 0.25 | nM | Ki | Bioorg Med Chem Lett (1995) 5: 1271-1274 |
GtoPdb | - | - | 9.7 | pKi | - | - | - |
J Pharmacol Exp Ther (1997) 281: 1303-11 [PMID:9190866]; Eur J Pharmacol (2002) 450: 191-202 [PMID:12206858] |
ChEMBL | In vitro inhibitory activity against human NK1 receptor was determined | B | 9.77 | pKi | 0.17 | nM | Ki | Bioorg Med Chem Lett (1995) 5: 2671-2676 |
ChEMBL | In vitro binding affinity for the Tachykinin receptor 1 in human IM-9 cell using [125I]BH-SP of the compound. | B | 9.77 | pKi | 0.17 | nM | Ki | J Med Chem (1992) 35: 4911-4913 [PMID:1282570] |
ChEMBL | Binding affinity towards human Tachykinin receptor 1 by the displacement of [125I]- Substance P in CHO Cells | B | 9 | pIC50 | 1 | nM | IC50 | Bioorg Med Chem Lett (1994) 4: 1917-1920 |
ChEMBL | Displacement of [3H]substance P from NK1 human receptor expressed in IM9 cells | B | 9.2 | pIC50 | 0.63 | nM | IC50 | Bioorg Med Chem Lett (2007) 17: 6887-6890 [PMID:17967540] |
ChEMBL | Inhibition of substance P binding to Tachykinin receptor 1 in Chinese hamster ovary cells | B | 9.22 | pIC50 | 0.6 | nM | IC50 | J Med Chem (2004) 47: 5381-5392 [PMID:15481976] |
ChEMBL | Displacement of [125I]- Substance P from human Neurokinin 1 (hNK1) receptor expressed in CHO cells | B | 9.22 | pIC50 | 0.6 | nM | IC50 | Bioorg Med Chem Lett (1995) 5: 209-212 |
ChEMBL | Binding affinity against human Tachykinin receptor 1 expressed in CHO cells was measured by its ability to displace [125I]- Tyr-8 substance P. | B | 9.3 | pIC50 | 0.5 | nM | IC50 | J Med Chem (1995) 38: 934-941 [PMID:7535362] |
ChEMBL | Binding affinity towards Neurokinin -1(NK-1) receptor of human by using [125I]- Tyr8 substance P as a radioligand in CHO cells | B | 9.3 | pIC50 | 0.5 | nM | IC50 | Bioorg Med Chem Lett (1995) 5: 1345-1350 |
ChEMBL | Displacement of [125 I]-Tyr8 SP from the cloned human Tachykinin receptor 1 expressed in CHO cells | B | 9.3 | pIC50 | 0.5 | nM | IC50 | J Med Chem (1996) 39: 2907-2914 [PMID:8709125] |
ChEMBL | Displacement of [125I]-labeled SP from human Tachykinin receptor 1 expressed in CHO cells | B | 9.3 | pIC50 | 0.5 | nM | IC50 | J Med Chem (1996) 39: 1760-1762 [PMID:8627597] |
ChEMBL | Antagonist activity for Tachykinin receptor 1 as displacement of [3H]-Substance P in human IM-9 cells | F | 9.31 | pIC50 | 0.49 | nM | IC50 | Bioorg Med Chem Lett (1998) 8: 281-284 [PMID:9871670] |
ChEMBL | Inhibition of [125I]-BH-Substance P binding to tachykinin receptor 1 in human IM-9 cells | B | 9.7 | pIC50 | 0.2 | nM | IC50 | J Med Chem (1995) 38: 3106-3120 [PMID:7543579] |
ChEMBL | Antagonist activity at NK1 receptor | F | 9.77 | pIC50 | 0.17 | nM | IC50 | J Med Chem (2011) 54: 2467-2476 [PMID:21413804] |
ChEMBL | Binding affinity was measured against the Tachykinin receptor 1 in human IM-9 cells using [3H]SP as ligand. | B | 9.77 | pIC50 | 0.17 | nM | IC50 | J Med Chem (1998) 41: 3609-3623 [PMID:9733486] |
Neurokinin 1 receptor in Guinea pig (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3942] [UniProtKB: P30547] | ||||||||
ChEMBL | Evaluated for the binding affinity towards NK1 receptor in the striatal membranes of guinea pig | B | 9.57 | pKi | 0.27 | nM | Ki | J Med Chem (1993) 36: 3197-3201 [PMID:7693945] |
ChEMBL | Evaluated for the binding affinity towards NK1 receptor in the striatal membranes of guinea pig | B | 9.77 | pKi | 0.17 | nM | Ki | J Med Chem (1993) 36: 3197-3201 [PMID:7693945] |
ChEMBL | In vitro binding affinity against Tachykinin receptor 1 in guinea pig ileum using organ bath assay | B | 8.54 | pIC50 | 2.9 | nM | IC50 | Bioorg Med Chem Lett (2001) 11: 705-709 [PMID:11266174] |
Neurokinin 2 receptor in Rabbit (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3433] [UniProtKB: P79218] | ||||||||
ChEMBL | Antagonistic potency for NK-2 receptor was determined in vitro, using isolated rabbit pulmonary artery. | F | 4 | pKd | >100000 | nM | Kd | Bioorg Med Chem Lett (1997) 7: 203-208 |
NK3 receptor/Neurokinin 3 receptor in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3154] [GtoPdb: 362] [UniProtKB: P16177] | ||||||||
ChEMBL | Antagonistic potency for NK-3 receptor was determined in vitro, using isolated rat portal vein. | F | 4 | pKd | >100000 | nM | Kd | Bioorg Med Chem Lett (1997) 7: 203-208 |
ChEMBL data shown on this page come from version 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]