Hydroxystilbamidine

Hydroxystilbamidine

SCHEMBL3338013

CS(=O)(=O)O.N=C(N)c1ccc(/C=C/c2ccc(C(=N)N)cc2O)cc1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of Hydroxystilbamidine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 known ✓ P00734 6/20 0.39
HTR2A known ✓ P28223 1/20 0.39
HTR2C known ✓ P28335 1/20 0.39
KDM4E B2RXH2 1/20 0.77
POLB P06746 1/20 0.77
MAPT P10636 1/20 0.77
RAD52 P43351 1/20 0.77
UBE2N P61088 1/20 0.77
NPSR1 Q6W5P4 1/20 0.77
PRMT1 Q99873 3/20 0.53
PRMT5 O14744 1/20 0.53
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53
CYP2C19 P33261 1/20 0.53
HSD17B10 Q99714 1/20 0.53
PLAU P00749 5/20 0.43
PLAT P00750 3/20 0.43
PLG P00747 2/20 0.43
KLK1 P06870 2/20 0.43
NQO2 P16083 1/20 0.41

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
Hydroxystilbamidine SCHEMBL17224190 1.00 KDM4E (0.77) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL26114123 1.00 KDM4E (0.77) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL108492 0.90 KDM4E (0.72) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL8482349 0.90 KDM4E (0.72) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL29439031 0.90 KDM4E (0.72) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL31614578 0.90 KDM4E (0.72) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL554644 0.87 POLB (1.00) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL10621745 0.87 POLB (1.00) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL10621740 0.87 POLB (1.00) KDM4EPOLBMAPTRAD52UBE2N
Hydroxystilbamidine SCHEMBL27618664 0.85 KDM4E (0.67) KDM4EPOLBMAPTRAD52UBE2N

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130073011-A1 METHOD FOR TREATING A PATIENT HAVING A SPINAL CORD INJURY USING PHOTOTHERAPY Henry M. Jackson Foundation for Advancement of Military Medicine (US) 2013-03-21 US disclosed
US-8328857-B2 Method for treating a patient having a spinal cord injury using phototherapy THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-12-11 US disclosed
US-20100152820-A1 METHOD FOR TREATING A PATIENT HAVING A SPINAL CORD INJURY USING PHOTOTHERAPY ANDERS JUANITA J 2010-06-17 US disclosed
US-7695504-B2 Method for regeneration and functional recovery after spinal cord injury using phototherapy THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-04-13 US disclosed
US-20080287381-A1 Injectable Agent for the Targeted Treatment of Retinal Ganglion Cells EBERHARD-KARLS-UNIVERSITAT TUBINGEN UNIVERSITATSKLINIKUM (DE) 2008-11-20 US disclosed
US-20080103562-A1 METHOD FOR REGENERATION AND FUNCTIONAL RECOVERY AFTER SPINAL CORD INJURY USING PHOTOTHERAPY PHOTOTHERA, INC. 2008-05-01 US disclosed
US-7344555-B2 Light promotes regeneration and functional recovery after spinal cord injury THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2008-03-18 US disclosed
US-20060036299-A1 Light promotes regeneration and functional recovery after spinal cord injury HENRY M. JACKSON FOUNDATION FOR THE ADVANCEMENT OF MILITARY MEDICINE 2006-02-16 US disclosed