Pentaquine

Pentaquine

SCHEMBL980723

COc1cc(NCCCCCNC(C)C)c2ncccc2c1

nearest known ligand 0.74

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 10/20 0.74
HSP90AB1 P08238 10/20 0.74
MEN1 O00255 3/20 0.72
KMT2A Q03164 3/20 0.72
ALDH1A1 P00352 4/20 0.71
HTT P42858 2/20 0.71
KDM4E B2RXH2 2/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
TDP2 O95551 1/20 0.71
FGB P02675 1/20 0.71
POLB P06746 1/20 0.71
GAA P10253 1/20 0.71
MAPT P10636 1/20 0.71
THRB P10828 1/20 0.71
TSHR P16473 1/20 0.71
NR4A1 P22736 1/20 0.71
RECQL P46063 1/20 0.71
RAB9A P51151 1/20 0.71
BLM P54132 1/20 0.71
TDP1 Q9NUW8 1/20 0.71

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Pentaquine SCHEMBL29596989 1.00 HSP90AA1 (0.74) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
Pentaquine SCHEMBL6081373 0.94 HSP90AA1 (0.67) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL8900580 0.86 HSP90AA1 (0.98) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL8891533 0.86 HSP90AA1 (0.98) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL8891243 0.86 HSP90AA1 (0.98) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL8891233 0.86 HSP90AA1 (0.98) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL13856507 0.85 HSP90AA1 (0.80) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL18163920 0.85 HSP90AA1 (0.80) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL8901953 0.85 HSP90AA1 (0.71) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1
SCHEMBL8901077 0.85 HSP90AA1 (0.71) HSP90AA1HSP90AB1MEN1KMT2AALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 200 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021211923-A1 COMPOSITIONS AND METHODS FOR TREATING DISEASE PULMOQUINE THERAPEUTICS, INC. (US) 2021-10-21 WO claimed
US-9016221-B2 Surface topographies for non-toxic bioadhesion control UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2015-04-28 US claimed
US-20100226943-A1 SURFACE TOPOGRAPHIES FOR NON-TOXIC BIOADHESION CONTROL UNIVERSITY OF FLORIDA (US) 2010-09-09 US claimed
US-7670631-B2 Method for the prevention of malaria infection of humans by hepatocyte growth factor antagonists ALFAMA—Investigação e Desenvolvimento de Produtos Farmacêuticos, Lda. (PT) 2010-03-02 US claimed
EP-1954244-A1 LYOPHILIZATION PROCESS AND PRODUCTS OBTAINED THEREBY Scidose, Llc (US) 2008-08-13 EP claimed
EP-1085086-B1 Method for producing L-histidine by fermentation using DNA gyrase inhibitor resistant bacterial strains KYOWA HAKKO KOGYO KK (JP) 2008-03-19 EP claimed
EP-1829528-A2 Aggregate with increased deformability, comprising at least three amphipats, for improved transport through semi-permeable barriers and for the non-invasive drug application in vivo, especially through the skin IDEA AG (DE) 2007-09-05 EP claimed
EP-1829527-A2 Aggregate with increased deformability, comprising at least three amphipats, for improved transport through semi-permeable barriers and for the non-invasive drug application in vivo, especially through the skin IDEA AG (DE) 2007-09-05 EP claimed
EP-1815846-A2 Aggregate with increased deformability, comprising at least three amphipats, for improved transport through semi-permeable barriers and for the non-invasive drug application in vivo, especially through the skin IDEA AG (DE) 2007-08-08 EP claimed
EP-1815847-A2 Aggregate with increased deformability, comprising at least three amphipats, for improved transport through semi-permeable barriers and for the non-invasive drug application in vivo, especially through the skin IDEA AG (DE) 2007-08-08 EP claimed
EP-0743573-A2 Method for obtaining image contrast migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0473094-B1 Process for producing L-tryptophan KYOWA HAKKO KOGYO KK (JP) 1995-06-21 EP claimed
EP-0473094-A2 Process for producing L-tryptophan KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1992-03-04 EP claimed
EP-0037175-B1 PHARMACEUTICAL COMPOSITIONS EFAMOL LIMITED (GB) 1988-02-10 EP claimed
EP-0035856-B1 PHARMACEUTICAL AND DIETARY COMPOSITIONS EFAMOL LIMITED (GB) 1984-07-04 EP claimed
EP-0037175-A1 Pharmaceutical compositions EFAMOL LIMITED (GB) 1981-10-07 EP claimed
EP-0035856-A2 Pharmaceutical and dietary compositions EFAMOL LIMITED (GB) 1981-09-16 EP claimed