Amantadine

Amantadine

SCHEMBL21801807

Cl.NC12CC3CC(CC(C3)C1)C2.O=[N+]([O-])O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BM

The experimentally established mechanism targets of Amantadine. 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
GRIN1 known ✓ Q05586 6/20 0.59
GRIN2A known ✓ Q12879 6/20 0.59
GRIN2D known ✓ O15399 5/20 0.59
GRIN3B known ✓ O60391 5/20 0.59
GRIN2B known ✓ Q13224 5/20 0.59
GRIN2C known ✓ Q14957 5/20 0.59
GRIN3A known ✓ Q8TCU5 5/20 0.59
LMNA P02545 4/20 0.64
THRB P10828 2/20 0.64
POLB P06746 2/20 0.64
PMP22 Q01453 2/20 0.64
BLM P54132 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
TSHR P16473 2/20 0.59
SLC22A1 O15245 2/20 0.59
SLC22A2 O15244 1/20 0.59
NFKB1 P19838 1/20 0.59
STAT6 P42226 1/20 0.59
SLC47A1 Q96FL8 1/20 0.59
SIGMAR1 Q99720 1/20 0.59

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
Amantadine SCHEMBL17292893 0.98 GRIN2D (0.62) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL28897313 0.98 GRIN2D (0.62) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL21801809 0.95 GRIN2D (0.59) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL20136303 0.80 LMNA (1.00) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL40713 0.80 LMNA (1.00) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL16109305 0.78 LMNA (0.82) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL29227879 0.77 LMNA (0.93) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL29011286 0.77 GRIN1 (0.87) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL28543969 0.77 LMNA (0.93) LMNATHRBPOLBPMP22BLM
Amantadine SCHEMBL21310017 0.77 GRIN1 (1.00) LMNATHRBPOLBPMP22BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3851433-A1 PREPARATION PROCESS FOR AMANTADINE NITRATE DERIVATIVE Qingdao Hailan Pharmaceuticals Co., Ltd. (CN) 2021-07-21 EP claimed
CN-109206317-B Preparation process of amantadine nitrate derivative 青岛海蓝医药有限公司 2021-07-09 CN claimed
WO-2020052179-A1 PREPARATION PROCESS FOR AMANTADINE NITRATE DERIVATIVE 青岛海蓝医药有限公司 2020-03-19 WO claimed
CN-109206317-A A kind of preparation process of adamantane amine nitrate derivatives 青岛海蓝医药有限公司 2019-01-15 CN claimed
EP-3851433-A1 PREPARATION PROCESS FOR AMANTADINE NITRATE DERIVATIVE Qingdao Hailan Pharmaceuticals Co., Ltd. (CN) 2021-07-21 EP disclosed
EP-3851433-A1 PREPARATION PROCESS FOR AMANTADINE NITRATE DERIVATIVE Qingdao Hailan Pharmaceuticals Co., Ltd. (CN) 2021-07-21 EP disclosed
CN-109206317-B Preparation process of amantadine nitrate derivative 青岛海蓝医药有限公司 2021-07-09 CN disclosed
WO-2020052179-A1 PREPARATION PROCESS FOR AMANTADINE NITRATE DERIVATIVE 青岛海蓝医药有限公司 2020-03-19 WO disclosed