Putrescine

Putrescine

SCHEMBL4812339

NCCCCN.O=[N+]([O-])O.O=[N+]([O-])O

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERG11

The experimentally established mechanism targets of Putrescine. 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
CA5A P35218 3/20 0.53
CA5B Q9Y2D0 3/20 0.53
NFKB1 P19838 3/20 0.47
LMNA P02545 4/20 0.44
BLM P54132 4/20 0.44
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA3 P07451 2/20 0.44
CA4 P22748 2/20 0.44
CA6 P23280 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA14 Q9ULX7 2/20 0.44
TSHR P16473 2/20 0.44
DNM1 Q05193 1/20 0.44
CYP2D6 P10635 1/20 0.41
NPSR1 Q6W5P4 2/20 0.39
THRB P10828 2/20 0.39
KMT2A Q03164 2/20 0.39

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
Nitric Acid SCHEMBL8214090 0.97 DNM1 (0.50) CA5ACA5BNFKB1LMNABLM
Nitric Acid SCHEMBL6736968 0.97 DNM1 (0.50) CA5ACA5BNFKB1LMNABLM
Nitric Acid SCHEMBL10620356 0.93
Nitric Acid SCHEMBL10940709 0.89 CA5A (0.42) CA5ACA5BNFKB1LMNABLM
Nitric Acid SCHEMBL28345264 0.87 DNM1 (0.57) CA5ACA5BTSHRDNM1KMT2A
Ethylenediamine SCHEMBL723589 0.86
Ethylenediamine SCHEMBL28858090 0.86 CA5A (0.61) CA5ACA5BLMNABLMTSHR
Ethylenediamine SCHEMBL721753 0.86 CA5A (0.61) CA5ACA5BLMNABLMTSHR
Ethylenediamine SCHEMBL6232364 0.86 CA5A (0.61) CA5ACA5BLMNABLMTSHR
Ethylenediamine SCHEMBL2733332 0.86 CA5A (0.61) CA5ACA5BLMNABLMTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5034073-A Explosive composition with binder AEROJET GENERAL CORPORATION (US) 1991-07-23 US claimed
US-7431083-B2 Sub-surface coalbed methane well enhancement through rapid oxidation SCHLUMBERGER TECHNOLOGY CORPORATION (US) 2008-10-07 US disclosed
US-20070240880-A1 Sub-Surface Coalbed Methane Well Enhancement Through Rapid Oxidation SCHLUMBERGER TECHNOLOGY CORPORATION 2007-10-18 US disclosed
EP-1845233-A1 Sub-surface coalbed methane well enhancement through rapid oxidation Services Pétroliers Schlumberger (FR) 2007-10-17 EP disclosed
US-5034073-A Explosive composition with binder AEROJET GENERAL CORPORATION (US) 1991-07-23 US disclosed