SCHEMBL901315

SCHEMBL901315

NCC(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 3/20 0.44
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.36
RAB9A P51151 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
CTSB P07858 3/20 0.35
ITGB2 P05107 1/20 0.35
ICAM1 P05362 1/20 0.35
ITGAL P20701 1/20 0.35
SLC15A2 Q16348 1/20 0.34
CA2 P00918 3/20 0.34
CA1 P00915 2/20 0.34
PTGS1 P23219 1/20 0.34
GSTK1 Q9Y2Q3 1/20 0.34
MMP8 P22894 1/20 0.33
QRFPR Q96P65 1/20 0.32

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
SCHEMBL8717807 1.00 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8720265 1.00 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8717768 0.97 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8717867 0.97 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL9228209 0.97 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL18109901 0.97 ECE1 (0.43) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8087169 0.97 ECE1 (0.46) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8200006 0.97 ECE1 (0.43) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL700301 0.97 ECE1 (0.46) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL5820202 0.97 ECE1 (0.46) ECE1MEN1KMT2AALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110079558-A With the method for 61 polypeptide pre-treating cellulosic material of family 诺维信股份有限公司 2019-08-02 CN disclosed
CN-108315272-A For using cellulose to carry out the yeast of synchronous glycosylation and the expression cellulase of fermentation 拉勒曼德匈牙利流动性管理有限责任公司 2018-07-24 CN disclosed
CN-107345226-A Polypeptide variants and its coded polynucleotide with cellulolytic enhancing activity 诺维信股份有限公司 2017-11-14 CN disclosed
CN-107190030-A Increase the method for cellulosic material hydrolysis in the presence of cellobiose dehydrogenase 诺维信股份有限公司 2017-09-22 CN disclosed
CN-107002056-A Carbohydrate-binding module variants and polynucleotides encoding same 诺维信公司 2017-08-01 CN disclosed
CN-103237891-B Polypeptide variants having cellulolytic enhancing activity and polynucleotides encoding same 诺维信股份有限公司 2017-07-14 CN disclosed
EP-2622068-A1 VARIANTS OF POLYPEPTIDES HAVING CELLULOLYTIC ENHANCING ACTIVITY AND POLYNUCLEOTIDES ENCODING SAME Novozymes, Inc. (US) 2013-08-07 EP disclosed
WO-2012044835-A1 VARIANTS OF POLYPEPTIDES HAVING CELLULOLYTIC ENHANCING ACTIVITY AND POLYNUCLEOTIDES ENCODING SAME NOVOZYMES, INC. (US) 2012-04-05 WO disclosed
CN-101910406-A Methods of reducing the inhibitory effect of a redox active metal ion on the enzymatic hydrolysis of cellulosic material NOVOZYMES INC 2010-12-08 CN disclosed
CN-101910405-A Methods of reducing the inhibitory effect of a tannin of the enzymatic hydrolysis of cellulosic material NOVOZYMES INC 2010-12-08 CN disclosed
CN-1620501-A Polypeptides having cellobiohydrolase i activity and polynucleotides encoding same NOVOZYMES AS (DK) 2005-05-25 CN disclosed