Ethambutol

Ethambutol

SCHEMBL8736108

CC[C@@H](CO)NCCN[C@@H](CC)CO.O=C(O)CS

nearest known ligand 0.68

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

embA

The experimentally established mechanism targets of Ethambutol. 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
LMNA P02545 2/20 0.68
CNR1 P21554 1/20 0.68
ADRA1A P35348 1/20 0.68
TDP1 Q9NUW8 1/20 0.68
KDM4E B2RXH2 1/20 0.68
ABCC3 O15438 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
ANPEP P15144 1/20 0.33
ENPEP Q07075 1/20 0.33
ALDH1A1 P00352 1/20 0.33
DPP4 P27487 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP8 P22894 1/20 0.31
CA9 Q16790 1/20 0.31
MME P08473 1/20 0.31
ACE P12821 1/20 0.31

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
Ethambutol SCHEMBL2319449 0.86 LMNA (0.71) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL8575513 0.85 LMNA (0.77) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL29131237 0.85 LMNA (0.77) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL2342754 0.83 LMNA (0.81) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL2961583 0.82 LMNA (1.00) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL4029 0.82 LMNA (1.00) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL15479016 0.82 LMNA (1.00) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL2636850 0.82 LMNA (1.00) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL3399 0.82 LMNA (1.00) LMNACNR1ADRA1ATDP1KDM4E
Ethambutol SCHEMBL9906602 0.82 LMNA (1.00) LMNACNR1ADRA1ATDP1KDM4E

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-0797442-A4 TREATMENT OF OPTIC NEURITIS MASSACHUSETTS EYE & EAR INFIRM (US) 1998-04-15 EP disclosed
EP-0797442-A1 TREATMENT OF OPTIC NEURITIS MASSACHUSETTS EYE & EAR INFIRMARY (US) 1997-10-01 EP disclosed
WO-1996000073-A1 TREATMENT OF OPTIC NEURITIS MASSACHUSETTS EYE AND EAR INFIRMARY (US) 1996-01-04 WO disclosed