Tetrahydroharman

Tetrahydroharman

SCHEMBL28697145

CC1NCCc2c1[nH]c1ccccc21.CCCOC=O

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 2/20 0.48
HTR2B P41595 1/20 0.48
PSMD14 O00487 1/20 0.48
POLB P06746 1/20 0.48
GAA P10253 1/20 0.48
MAPKAPK2 P49137 1/20 0.47
HTR7 P34969 7/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C19 P33261 1/20 0.47
GRIN2B Q13224 1/20 0.46
CHRM4 P08173 4/20 0.45
DRD2 P14416 2/20 0.43
PRMT5 O14744 1/20 0.41
EGFR P00533 1/20 0.41

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
Tetrahydroharman SCHEMBL7018798 0.83 HTR7 (0.65) MAPTALDH1A1KDM4EHTR2BPSMD14
Tetrahydroharman SCHEMBL29630308 0.83 HTR7 (0.65) MAPTALDH1A1KDM4EHTR2BPSMD14
Tetrahydroharman SCHEMBL29630296 0.83 HTR7 (0.65) MAPTALDH1A1KDM4EHTR2BPSMD14
Tetrahydroharman SCHEMBL21012020 0.83 HTR7 (0.65) MAPTALDH1A1KDM4EHTR2BPSMD14
SCHEMBL24428198 0.75 BRD3 (0.55) MAPTALDH1A1KDM4EHTR2BPSMD14
SCHEMBL8322968 0.71 GRIN2B (0.70) MAPKAPK2HTR7CYP3A4CYP2D6CYP2C19
SCHEMBL21883968 0.71 GRIN2B (0.70) MAPKAPK2HTR7CYP3A4CYP2D6CYP2C19
SCHEMBL29756361 0.71 GRIN2B (0.70) MAPKAPK2HTR7CYP3A4CYP2D6CYP2C19
SCHEMBL273473 0.71 MAPKAPK2 (0.67) ALDH1A1KDM4EMAPKAPK2HTR7CYP3A4
SCHEMBL10481507 0.71 MAPKAPK2 (0.67) ALDH1A1KDM4EMAPKAPK2HTR7CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114057738-A Synthesis method of chloroindole hydrazide 京博农化科技有限公司 2022-02-18 CN disclosed