Ethylenediamine

Ethylenediamine

SCHEMBL7097461

NCCN.NCCN.NCCN.O.O.O.[Cl-].[Cl-].[Cl-].[Co+3]

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Ethylenediamine. 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
NFKB1 P19838 1/20 0.36
TSHR P16473 3/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA3 P07451 2/20 0.33
CA4 P22748 2/20 0.33
CA6 P23280 2/20 0.33
CA5A P35218 2/20 0.33
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
CA14 Q9ULX7 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
BLM P54132 2/20 0.33
DNM1 Q05193 1/20 0.33
LOX P28300 1/20 0.33
LOXL3 P58215 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33

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
Ethylenediamine SCHEMBL1450484 1.00 NFKB1 (0.36) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL440459 0.94 NFKB1 (0.40) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL8214834 0.94
Ethylenediamine SCHEMBL1450120 0.88 NFKB1 (0.36) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL5462840 0.88 NFKB1 (0.36) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL17841696 0.88 NFKB1 (0.36) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL3145323 0.88 NFKB1 (0.36) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL28250723 0.88
Ethylenediamine SCHEMBL3148612 0.88 NFKB1 (0.36) NFKB1TSHRCA12CA1CA2
Ethylenediamine SCHEMBL5083587 0.87

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020012976-A1 METHOD OF PRODUCING A TAXANE-TYPE DITERPENE AND A METHOD OF OBTAINING CULTURED CELLS WHICH PRODUCE THE TAXANE-TYPE DILTERPENE AT A HIGH RATE YUKIMUNE YUKIHITO (JP) 2002-01-31 US claimed
EP-1063299-A2 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate Mitsui Chemicals, Inc. (JP) 2000-12-27 EP claimed
EP-1063300-A2 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate Mitsui Chemicals, Inc. (JP) 2000-12-27 EP claimed
EP-1054065-A1 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate Mitsui Chemicals, Inc. (JP) 2000-11-22 EP claimed
US-5637484-A CULTURING TISSUES OR CELLS OF PLANT BELONGING TO GENUS TAXUS IN PRESENCE OF JASMONIC ACID, RECOVERING TAXANE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-06-10 US claimed
EP-0683232-A1 PROCESS FOR PRODUCING TAXANE DITERPENE AND METHOD OF HARVESTING CULTRED CELL CAPABLE OF PRODUCING TAXANE DITERPENE IN HIGH YIELD MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-11-22 EP claimed
EP-1348764-A1 A Method of Producing a Taxane-Type Diterpene and Method of Obtaining Cultured Cells which Produce the Taxane-Type Diterpene at a High Rate Mitsui Chemicals, Inc. (JP) 2003-10-01 EP disclosed
EP-1063300-B1 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate MITSUI CHEMICALS INC (JP) 2003-09-03 EP disclosed
EP-1054065-B1 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate MITSUI CHEMICALS INC (JP) 2002-07-31 EP disclosed
US-6403343-B2 PLANT EXTRACT MITSUI CHEMICALS, INC. (JP) 2002-06-11 US disclosed
US-20020012976-A1 METHOD OF PRODUCING A TAXANE-TYPE DITERPENE AND A METHOD OF OBTAINING CULTURED CELLS WHICH PRODUCE THE TAXANE-TYPE DILTERPENE AT A HIGH RATE YUKIMUNE YUKIHITO (JP) 2002-01-31 US disclosed
EP-1063300-A2 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate Mitsui Chemicals, Inc. (JP) 2000-12-27 EP disclosed
EP-1063299-A2 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate Mitsui Chemicals, Inc. (JP) 2000-12-27 EP disclosed
EP-1054065-A1 A method of producing a taxane-type diterpene and method of obtaining cultured cells which produce the taxane-type diterpene at a high rate Mitsui Chemicals, Inc. (JP) 2000-11-22 EP disclosed
US-5968789-A CULTURING TISSUES OR CELLS OF PLANT FROM GENUS TAXUS IN NUTRIENT MEDIUM AND IN CONTACT WITH GAS HAVING OXYGEN AND 0.1 TO 5% CARBON DIOXIDE, RECOVERING COMPOUND FROM CULTURE MITSUI CHEMICALS, LTD. (JP) 1999-10-19 US disclosed
US-5637484-A CULTURING TISSUES OR CELLS OF PLANT BELONGING TO GENUS TAXUS IN PRESENCE OF JASMONIC ACID, RECOVERING TAXANE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1997-06-10 US disclosed
EP-0683232-A1 PROCESS FOR PRODUCING TAXANE DITERPENE AND METHOD OF HARVESTING CULTRED CELL CAPABLE OF PRODUCING TAXANE DITERPENE IN HIGH YIELD MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-11-22 EP disclosed
US-4615777-A Method and composition for reducing the voltage in an electrolytic cell OLIN CORPORATION (US) 1986-10-07 US disclosed