Dansylsarcosine

Dansylsarcosine

SCHEMBL5500548

CN(C)c1cccc2c(S(=O)(=O)N(C)CC(=O)O)cccc12.O=C(O)c1cc(I)cc(I)c1I

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
HIF1A Q16665 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
STAT3 P40763 1/20 0.44
PTPRS Q13332 1/20 0.44
CA2 P00918 1/20 0.40
ABCB1 P08183 1/20 0.40
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
HDAC3 O15379 3/20 0.39
HDAC1 Q13547 3/20 0.39
HDAC2 Q92769 3/20 0.39
NCOR2 Q9Y618 3/20 0.39
HDAC6 Q9UBN7 2/20 0.39
BCL2 P10415 1/20 0.38

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
2,3,5-Triiodobenzoic Acid SCHEMBL5500551 0.86 MCL1 (0.38) L3MBTL1TDP1PTPN2PTPN1STAT3
Dansylsarcosine SCHEMBL30586115 0.84 L3MBTL1 (0.61) L3MBTL1CYP1A2CYP2C19HTTHIF1A
Dansylsarcosine SCHEMBL39162 0.84 L3MBTL1 (0.61) L3MBTL1CYP1A2CYP2C19HTTHIF1A
Dansylsarcosine SCHEMBL23850005 0.75 CYP1A2 (0.50) L3MBTL1CYP1A2CYP2C19HTTHIF1A
Dansylsarcosine SCHEMBL30745135 0.75 CYP1A2 (0.50) L3MBTL1CYP1A2CYP2C19HTTHIF1A
SCHEMBL15627403 0.70 CYP1A2 (0.56) L3MBTL1CYP1A2CYP2C19HTTHIF1A
SCHEMBL11888757 0.69 KEAP1 (0.66) L3MBTL1PTPN2PTPN1STAT3PTPRS
SCHEMBL26005791 0.69 CYP1A2 (0.77) L3MBTL1CYP1A2CYP2C19HTTHIF1A
SCHEMBL12964231 0.68 CYP1A2 (0.62) L3MBTL1CYP1A2CYP2C19HTTHIF1A
SCHEMBL14178940 0.68 CYP1A2 (0.59) L3MBTL1CYP1A2CYP2C19HTTHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1575515-A4 ACHAETE-SCUTE LIKE-2 POLYPEPTIDES AND ENCODING NUCLEIC ACIDS AND METHODS FOR THE DIAGNOSIS AND TREATMENT OF TUMOR GENENTECH INC (US) 2007-08-08 EP disclosed
EP-1575515-A2 ACHAETE-SCUTE LIKE-2 POLYPEPTIDES AND ENCODING NUCLEIC ACIDS AND METHODS FOR THE DIAGNOSIS AND TREATMENT OF TUMOR Genentech, Inc. (US) 2005-09-21 EP disclosed
WO-2004019857-A2 ACHAETE-SCUTE LIKE-2 POLYPEPTIDES AND ENCODING NUCLEIC ACIDS AND METHODS FOR THE DIAGNOSIS AND TREATMENT OF TUMOR GENENTECH, INC. (US) 2004-03-11 WO disclosed