Compile Data Set for Download or QSAR

Found 44 hits Enz. Inhib. hit(s) with all data for entry = 11650   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636722 ((R)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(1-(2-...) Show SMILES C[C@](O)(CS(=O)(=O)C1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636718 (US11826430, Compound 1.2a) Show SMILES Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(cc1)N1C(=S)N(C(=O)C1(C)C)c1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636723 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(1-(2-...) Show SMILES C[C@](O)(COC1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636724 (N-(2-(3-(4-cyano-3-(trifluoromethyl)phenyl)-5,5-di...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636721 (4-(3-(1-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-...) Show SMILES CC1(C)N(C2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636722 ((R)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(1-(2-...) Show SMILES C[C@](O)(CS(=O)(=O)C1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636726 (US11826430, Compound 1.8 | imidazolidin-1-yl)ethyl...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=O)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636725 (N-(2-(5,5-dimethyl-3-(4-nitro-3-(trifluoromethyl)p...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=O)N(C1=O)c1ccc(c(c1)C(F)(F)F)[N+]([O-])=O Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636718 (US11826430, Compound 1.2a) Show SMILES Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(cc1)N1C(=S)N(C(=O)C1(C)C)c1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636723 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(1-(2-...) Show SMILES C[C@](O)(COC1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636728 (4-(3-(4-(6-(3,5-difluoro-4-((1R,3R)-2-(2-fluoro-2-...) Show SMILES C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(OCCCCCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1F |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636721 (4-(3-(1-(2-fluoro-5-((4-oxo-3,4-dihydrophthalazin-...) Show SMILES CC1(C)N(C2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor (Homo sapiens (Human))	BDBM636731 ((E)-4-(3-(4-(2-(3-(4-(2-(4-chloro-2-fluorophenyl)-...) Show SMILES CC\C(=C(\c1ccc(OCCCOCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636729 (4-(3-(4-(2-(3,5-difluoro-4-((1S,3S)-2-(2-fluoro-2-...) Show SMILES C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(OCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1F |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor (Homo sapiens (Human))	BDBM636727 ((E)-4-(3-(4-(6-(4-(2-(4-chloro-2-fluorophenyl)-1-(...) Show SMILES CC\C(=C(\c1ccc(OCCCCCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636724 (N-(2-(3-(4-cyano-3-(trifluoromethyl)phenyl)-5,5-di...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636732 ((E)-4-(3-(4-(2-(3-(4-(2-(4-chloro-2-fluorophenyl)-...) Show SMILES CC\C(=C(\c1ccc(OCCCOCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor (Homo sapiens (Human))	BDBM636730 (E)-4-(3-(4-(6-(4-(2-(4-chloro-2-fluorophenyl)-1-(1...) Show SMILES CC\C(=C(\c1ccc(OCCCCCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor (Homo sapiens (Human))	BDBM636728 (4-(3-(4-(6-(3,5-difluoro-4-((1R,3R)-2-(2-fluoro-2-...) Show SMILES C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(OCCCCCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1F |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	5.70	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636731 ((E)-4-(3-(4-(2-(3-(4-(2-(4-chloro-2-fluorophenyl)-...) Show SMILES CC\C(=C(\c1ccc(OCCCOCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636725 (N-(2-(5,5-dimethyl-3-(4-nitro-3-(trifluoromethyl)p...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=O)N(C1=O)c1ccc(c(c1)C(F)(F)F)[N+]([O-])=O Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636727 ((E)-4-(3-(4-(6-(4-(2-(4-chloro-2-fluorophenyl)-1-(...) Show SMILES CC\C(=C(\c1ccc(OCCCCCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636726 (US11826430, Compound 1.8 | imidazolidin-1-yl)ethyl...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=O)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636720 ((Peak-2) | US11826430, Compound 1.2b) Show SMILES Cn1ncnc1[C@H]1[C@@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(cc1)N1C(=S)N(C(=O)C1(C)C)c1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636728 (4-(3-(4-(6-(3,5-difluoro-4-((1R,3R)-2-(2-fluoro-2-...) Show SMILES C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(OCCCCCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1F |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636729 (4-(3-(4-(2-(3,5-difluoro-4-((1S,3S)-2-(2-fluoro-2-...) Show SMILES C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(OCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1F |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636730 (E)-4-(3-(4-(6-(4-(2-(4-chloro-2-fluorophenyl)-1-(1...) Show SMILES CC\C(=C(\c1ccc(OCCCCCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636719 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-((8...) Show SMILES Cn1ncnc1[C@H]1[C@@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(OC[C@](C)(O)C(=O)Nc2ccc(C#N)c(c2)C(F)(F)F)cc1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636732 ((E)-4-(3-(4-(2-(3-(4-(2-(4-chloro-2-fluorophenyl)-...) Show SMILES CC\C(=C(\c1ccc(OCCCOCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor (Homo sapiens (Human))	BDBM636729 (4-(3-(4-(2-(3,5-difluoro-4-((1S,3S)-2-(2-fluoro-2-...) Show SMILES C[C@@H]1Cc2c([nH]c3ccccc23)[C@H](N1CC(C)(C)F)c1c(F)cc(OCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1F |r| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636720 ((Peak-2) | US11826430, Compound 1.2b) Show SMILES Cn1ncnc1[C@H]1[C@@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(cc1)N1C(=S)N(C(=O)C1(C)C)c1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636719 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-((8...) Show SMILES Cn1ncnc1[C@H]1[C@@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(OC[C@](C)(O)C(=O)Nc2ccc(C#N)c(c2)C(F)(F)F)cc1 |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
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Estrogen receptor (Homo sapiens (Human))	BDBM636732 ((E)-4-(3-(4-(2-(3-(4-(2-(4-chloro-2-fluorophenyl)-...) Show SMILES CC\C(=C(\c1ccc(OCCCOCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	64.1	n/a	n/a	n/a	n/a	n/a	n/a
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Androgen receptor (Homo sapiens (Human))	BDBM636724 (N-(2-(3-(4-cyano-3-(trifluoromethyl)phenyl)-5,5-di...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=S)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636731 ((E)-4-(3-(4-(2-(3-(4-(2-(4-chloro-2-fluorophenyl)-...) Show SMILES CC\C(=C(\c1ccc(OCCCOCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636730 (E)-4-(3-(4-(6-(4-(2-(4-chloro-2-fluorophenyl)-1-(1...) Show SMILES CC\C(=C(\c1ccc(OCCCCCCN2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	187	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636727 ((E)-4-(3-(4-(6-(4-(2-(4-chloro-2-fluorophenyl)-1-(...) Show SMILES CC\C(=C(\c1ccc(OCCCCCC(=O)N2CCN(CC2)C(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)cc1)c1ccc2[nH]ncc2c1)c1ccc(Cl)cc1F Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	204	n/a	n/a	n/a	n/a	n/a	n/a
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Androgen receptor (Homo sapiens (Human))	BDBM636726 (US11826430, Compound 1.8 | imidazolidin-1-yl)ethyl...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=O)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	503	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 1 (Homo sapiens (Human))	BDBM636717 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-((8...) Show SMILES Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(OC[C@](C)(O)C(=O)Nc2ccc(C#N)c(c2)C(F)(F)F)cc1 |r| Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Poly [ADP-ribose] polymerase 2 (Homo sapiens (Human))	BDBM636717 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(4-((8...) Show SMILES Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(OC[C@](C)(O)C(=O)Nc2ccc(C#N)c(c2)C(F)(F)F)cc1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Androgen receptor (Homo sapiens (Human))	BDBM636722 ((R)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(1-(2-...) Show SMILES C[C@](O)(CS(=O)(=O)C1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	1.03E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Androgen receptor (Homo sapiens (Human))	BDBM636718 (US11826430, Compound 1.2a) Show SMILES Cn1ncnc1[C@@H]1[C@H](Nc2cc(F)cc3c2c1n[nH]c3=O)c1ccc(cc1)N1C(=S)N(C(=O)C1(C)C)c1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	>3.75E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Androgen receptor (Homo sapiens (Human))	BDBM636725 (N-(2-(5,5-dimethyl-3-(4-nitro-3-(trifluoromethyl)p...) Show SMILES CC1(C)N(CCNC(=O)c2cc(Cc3n[nH]c(=O)c4ccccc34)ccc2F)C(=O)N(C1=O)c1ccc(c(c1)C(F)(F)F)[N+]([O-])=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	4.62E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Androgen receptor (Homo sapiens (Human))	BDBM636723 ((S)—N-(4-cyano-3-(trifluoromethyl)phenyl)-3-(1-(2-...) Show SMILES C[C@](O)(COC1CCN(CC1)C(=O)c1cc(Cc2n[nH]c(=O)c3ccccc23)ccc1F)C(=O)Nc1ccc(C#N)c(c1)C(F)(F)F |r| Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
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