Ki Summary

Reaction Details

Report a problem with these data

Target

Histone acetyltransferase p300

Ligand

BDBM50255525

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_515393 (CHEMBL1025548)

IC50

8150±n/a nM

Citation

Wu, J; Xie, N; Wu, Z; Zhang, Y; Zheng, YG Bisubstrate Inhibitors of the MYST HATs Esa1 and Tip60. Bioorg Med Chem17:1381-6 (2009) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Histone acetyltransferase p300

Name:

Histone acetyltransferase p300

Synonyms:

EP300 | EP300_HUMAN | HIF1A/p300/CREB-binding protein | Histone acetyltransferase p300/Hypoxia-inducible factor 1-alpha | P300

Type:

Protein

Mol. Mass.:

264223.04

Organism:

Homo sapiens (Human)

Description:

Q09472

Residue:

2414

Sequence:

MAENVVEPGPPSAKRPKLSSPALSASASDGTDFGSLFDLEHDLPDELINSTELGLTNGGD
INQLQTSLGMVQDAASKHKQLSELLRSGSSPNLNMGVGGPGQVMASQAQQSSPGLGLINS
MVKSPMTQAGLTSPNMGMGTSGPNQGPTQSTGMMNSPVNQPAMGMNTGMNAGMNPGMLAA
GNGQGIMPNQVMNGSIGAGRGRQNMQYPNPGMGSAGNLLTEPLQQGSPQMGGQTGLRGPQ
PLKMGMMNNPNPYGSPYTQNPGQQIGASGLGLQIQTKTVLSNNLSPFAMDKKAVPGGGMP
NMGQQPAPQVQQPGLVTPVAQGMGSGAHTADPEKRKLIQQQLVLLLHAHKCQRREQANGE
VRQCNLPHCRTMKNVLNHMTHCQSGKSCQVAHCASSRQIISHWKNCTRHDCPVCLPLKNA
GDKRNQQPILTGAPVGLGNPSSLGVGQQSAPNLSTVSQIDPSSIERAYAALGLPYQVNQM
PTQPQVQAKNQQNQQPGQSPQGMRPMSNMSASPMGVNGGVGVQTPSLLSDSMLHSAINSQ
NPMMSENASVPSLGPMPTAAQPSTTGIRKQWHEDITQDLRNHLVHKLVQAIFPTPDPAAL
KDRRMENLVAYARKVEGDMYESANNRAEYYHLLAEKIYKIQKELEEKRRTRLQKQNMLPN
AAGMVPVSMNPGPNMGQPQPGMTSNGPLPDPSMIRGSVPNQMMPRITPQSGLNQFGQMSM
AQPPIVPRQTPPLQHHGQLAQPGALNPPMGYGPRMQQPSNQGQFLPQTQFPSQGMNVTNI
PLAPSSGQAPVSQAQMSSSSCPVNSPIMPPGSQGSHIHCPQLPQPALHQNSPSPVPSRTP
TPHHTPPSIGAQQPPATTIPAPVPTPPAMPPGPQSQALHPPPRQTPTPPTTQLPQQVQPS
LPAAPSADQPQQQPRSQQSTAASVPTPTAPLLPPQPATPLSQPAVSIEGQVSNPPSTSST
EVNSQAIAEKQPSQEVKMEAKMEVDQPEPADTQPEDISESKVEDCKMESTETEERSTELK
TEIKEEEDQPSTSATQSSPAPGQSKKKIFKPEELRQALMPTLEALYRQDPESLPFRQPVD
PQLLGIPDYFDIVKSPMDLSTIKRKLDTGQYQEPWQYVDDIWLMFNNAWLYNRKTSRVYK
YCSKLSEVFEQEIDPVMQSLGYCCGRKLEFSPQTLCCYGKQLCTIPRDATYYSYQNRYHF
CEKCFNEIQGESVSLGDDPSQPQTTINKEQFSKRKNDTLDPELFVECTECGRKMHQICVL
HHEIIWPAGFVCDGCLKKSARTRKENKFSAKRLPSTRLGTFLENRVNDFLRRQNHPESGE
VTVRVVHASDKTVEVKPGMKARFVDSGEMAESFPYRTKALFAFEEIDGVDLCFFGMHVQE
YGSDCPPPNQRRVYISYLDSVHFFRPKCLRTAVYHEILIGYLEYVKKLGYTTGHIWACPP
SEGDDYIFHCHPPDQKIPKPKRLQEWYKKMLDKAVSERIVHDYKDIFKQATEDRLTSAKE
LPYFEGDFWPNVLEESIKELEQEEEERKREENTSNESTDVTKGDSKNAKKKNNKKTSKNK
SSLSRGNKKKPGMPNVSNDLSQKLYATMEKHKEVFFVIRLIAGPAANSLPPIVDPDPLIP
CDLMDGRDAFLTLARDKHLEFSSLRRAQWSTMCMLVELHTQSQDRFVYTCNECKHHVETR
WHCTVCEDYDLCITCYNTKNHDHKMEKLGLGLDDESNNQQAAATQSPGDSRRLSIQRCIQ
SLVHACQCRNANCSLPSCQKMKRVVQHTKGCKRKTNGGCPICKQLIALCCYHAKHCQENK
CPVPFCLNIKQKLRQQQLQHRLQQAQMLRRRMASMQRTGVVGQQQGLPSPTPATPTTPTG
QQPTTPQTPQPTSQPQPTPPNSMPPYLPRTQAAGPVSQGKAAGQVTPPTPPQTAQPPLPG
PPPAAVEMAMQIQRAAETQRQMAHVQIFQRPIQHQMPPMTPMAPMGMNPPPMTRGPSGHL
EPGMGPTGMQQQPPWSQGGLPQPQQLQSGMPRPAMMSVAQHGQPLNMAPQPGLGQVGISP
LKPGTVSQQALQNLLRTLRSPSSPLQQQQVLSILHANPQLLAAFIKQRAAKYANSNPQPI
PGQPGMPQGQPGLQPPTMPGQQGVHSNPAMQNMNPMQAGVQRAGLPQQQPQQQLQPPMGG
MSPQAQQMNMNHNTMPSQFRDILRRQQMMQQQQQQGAGPGIGPGMANHNQFQQPQGVGYP
PQQQQRMQHHMQQMQQGNMGQIGQLPQALGAEAGASLQAYQQRLLQQQMGSPVQPNPMSP
QQHMLPNQAQSPHLQGQQIPNSLSNQVRSPQPVPSPRPQSQPPHSSPSPRMQPQPSPHHV
SPQTSSPHPGLVAAQANPMEQGHFASPDQNSMLSQLASNPGMANLHGASATDLGLSTDNS
DLNSNLSQSTLDIH

BDBM50255525

n/a

Name

BDBM50255525

Synonyms:

Ac-SGRGKGGK(CoA)GLGKGGAKRHRK | CHEMBL448227

Type

Small organic molecule

Emp. Form.

C107H188N43O40P3S

Mol. Mass.

2841.888

SMILES

CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CCCCNC(=O)CSCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)NC(=O)CNC(=O)CNC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@H](CO)NC(C)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)NCC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(O)=O |r,wU:139.142,53.54,51.51,93.103,80.88,153.155,32.32,108.113,174.177,wD:48.47,50.59,4.4,122.124,144.146,164.166,185.188,12.71,(30.94,-27.66,;30.94,-26.11,;32.27,-25.35,;29.62,-25.34,;29.62,-23.78,;28.29,-23.01,;27,-23.86,;26.99,-25.41,;25.66,-23.07,;24.28,-23.77,;22.95,-22.99,;22.96,-21.46,;21.6,-23.77,;21.59,-25.32,;22.92,-26.09,;22.91,-27.64,;24.24,-28.41,;24.13,-29.95,;22.85,-30.79,;22.84,-32.34,;21.51,-30.01,;20.16,-30.78,;20.16,-32.32,;18.81,-33.09,;18.72,-34.63,;20.05,-35.4,;21.38,-34.64,;20.04,-36.96,;21.37,-37.73,;21.34,-39.27,;20,-40.04,;18.66,-39.26,;19.99,-41.57,;18.61,-42.33,;21.32,-42.33,;22.66,-43.11,;20.54,-43.68,;22.09,-41.02,;23.64,-41.02,;24.41,-39.69,;25.09,-38.34,;23.08,-38.93,;25.75,-40.48,;27.08,-39.72,;28.36,-38.93,;26.32,-38.38,;27.86,-41.06,;27.08,-42.4,;27.84,-43.73,;27.19,-45.15,;28.33,-46.17,;29.67,-45.42,;30.96,-46.03,;29.36,-43.91,;30.41,-42.78,;31.91,-43.11,;33.34,-43.43,;32.19,-41.6,;31.57,-44.61,;28.16,-47.71,;26.83,-48.47,;27.14,-49.98,;28.66,-50.15,;29.56,-51.4,;28.92,-52.8,;31.09,-51.26,;31.73,-49.85,;30.83,-48.59,;29.3,-48.75,;20.27,-22.99,;18.93,-23.76,;18.92,-25.29,;17.59,-22.98,;16.24,-23.73,;14.9,-22.97,;14.9,-21.41,;13.57,-23.73,;12.24,-22.95,;10.92,-23.73,;10.91,-25.27,;9.58,-22.96,;9.58,-21.4,;10.93,-20.63,;10.93,-19.1,;12.28,-18.33,;12.27,-16.74,;8.21,-23.66,;6.85,-22.92,;6.86,-21.37,;5.53,-23.68,;4.22,-22.87,;2.93,-23.71,;2.93,-25.24,;1.59,-22.92,;1.59,-21.38,;2.94,-20.6,;2.94,-19.07,;4.22,-18.2,;4.3,-16.67,;2.9,-15.81,;5.58,-15.81,;.21,-23.61,;-1.14,-22.88,;-1.14,-21.32,;-2.47,-23.64,;-3.77,-22.83,;-5.04,-23.71,;-5.03,-25.24,;-6.39,-22.92,;-6.37,-21.38,;-5.03,-20.6,;-7.73,-23.68,;-9.07,-22.92,;-10.39,-23.68,;-9.06,-21.37,;30.95,-23.02,;30.95,-21.49,;32.27,-23.8,;33.65,-23.1,;34.99,-23.89,;34.98,-25.44,;36.28,-23.06,;37.61,-23.84,;37.61,-25.39,;38.93,-26.16,;38.93,-27.71,;40.25,-28.48,;40.18,-29.99,;38.94,-23.08,;38.94,-21.55,;40.27,-23.85,;41.64,-23.14,;42.98,-23.92,;42.98,-25.47,;44.28,-23.1,;45.61,-23.87,;46.93,-23.11,;46.94,-21.58,;48.27,-23.88,;49.63,-23.16,;49.64,-21.62,;50.97,-23.94,;50.97,-25.49,;52.28,-23.13,;53.62,-23.9,;53.61,-25.46,;54.93,-26.23,;54.93,-27.78,;56.26,-28.55,;56.19,-30.08,;54.94,-23.14,;54.95,-21.61,;56.28,-23.91,;57.64,-23.18,;57.65,-21.65,;58.99,-20.88,;59,-19.34,;60.32,-18.55,;60.36,-17.01,;58.99,-16.21,;61.66,-16.21,;58.98,-23.96,;58.98,-25.51,;60.29,-23.16,;61.61,-23.94,;61.61,-25.49,;62.92,-26.27,;64.3,-25.68,;65.34,-26.82,;64.57,-28.15,;63.07,-27.8,;62.93,-23.19,;62.94,-21.66,;64.27,-23.95,;65.61,-23.19,;65.62,-21.67,;66.96,-20.9,;66.97,-19.36,;68.31,-18.61,;68.34,-17.07,;66.98,-16.31,;69.67,-16.29,;66.95,-23.97,;66.95,-25.52,;68.29,-23.2,;69.62,-23.98,;69.62,-25.53,;70.94,-26.3,;70.94,-27.86,;72.26,-28.63,;72.25,-30.18,;70.95,-23.22,;72.29,-24,;70.96,-21.69,)|

Structure