Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6202263

Cn1ncc(Br)c1-c1ccccc1.N.N

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.46
HIF1A Q16665 1/20 0.41
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CHEK1 O14757 1/20 0.37
CCNA2 P20248 1/20 0.37
CDK2 P24941 1/20 0.37
CCNA1 P78396 1/20 0.37
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
PAX8 Q06710 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
PDE2A O00408 2/20 0.36
PRMT5 O14744 1/20 0.36

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
SCHEMBL3562130 0.98 HTR2A (0.47) HTR2AHIF1ACA1CA2CHEK1
SCHEMBL23087698 0.81 NPC1 (0.41) HTR2AHTTSMN1; SMN2NPC1RAB9A
SCHEMBL4137079 0.81 BRAF (0.42) HTR2ALMNAMAPTHTR2CAKT1
SCHEMBL15885278 0.80 CYP2A6 (0.47) HTR2AHIF1AHTTSMN1; SMN2NPC1
SCHEMBL5946818 0.80 HTR2A (0.58) HTR2ASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL9933261 0.79 HTR2A (0.54) HTR2APDE2APRMT5WDR77PTGS1
SCHEMBL3489027 0.79 HTR2A (0.45) HTR2APDE2APRMT5WDR77HTR2C
SCHEMBL23087650 0.79 HTR2A (0.51) HTR2ASMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL23087462 0.78 HTR2A (0.46) HTR2AHIF1ASMN1; SMN2NPC1RAB9A
SCHEMBL27217102 0.78 HTR2A (0.40) HTR2ACHEK1CCNA2CDK2CCNA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509505-A2 SMALL MOLECULE MODULATORS OF THE 5−HT2A SEROTONIN RECEPTOR USEFUL FOR THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2005-03-02 EP disclosed
WO-2003062206-A2 SMALL MOLECULE MODULATORS OF THE 5-HT2A SEROTONIN RECEPTOR USEFUL FOR THE PROPHYLAXIS AND TREATMENT OF DISORDERS RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2003-07-31 WO disclosed