BDBM1944 BHAP deriv.::CHEMBL593::DELAVIRDINE MESYLATE::Delavirdine::N-[2-({4-[3-(propan-2-ylamino)pyridin-2-yl]piperazin-1-yl}carbonyl)-1H-indol-5-yl]methanesulfonamide::Rescriptor::U-90152S

SMILES: CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(ccc4[nH]3)NS(=O)(=O)C

InChI Key: InChIKey=WHBIGIKBNXZKFE-UHFFFAOYSA-N

Data: 42 IC50  3 EC50

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 45 hits for monomerid = 1944   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Integrase (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Broad substrate specificity ATP-binding cassette transporter ABCG2 (Human)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.87E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [489-587] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	422	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Chymotrypsinogen A (Bovine)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.25E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Beta-lactamase (Escherichia coli (strain K12))	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Malate dehydrogenase, cytoplasmic (Human)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.22E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cruzipain (Trypanosoma cruzi)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	657	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027]/[588-1147] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	260	n/a	n/a	n/a	n/a	8.3	28
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027,P823L]/[588-1147,P823L] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1127,Y768C]/[588-1147,Y768C] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027]/[588-1147] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	8.3	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027]/[588-1147] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1127,Y768C]/[588-1147,Y768C] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	114	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027,K690N]/[588-1147,K690N] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	625	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027]/[588-1147] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	422	n/a	n/a	n/a	n/a	8.2	37
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	76	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>2.30E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Gag-Pol polyprotein [588-1027]/[588-1147] (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	394	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase protein (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase/RNaseH (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM1944 (BHAP deriv. | N-[2-({4-[3-(propan-2-ylamino)pyridi...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair