Indole

Indole

SCHEMBL28979810

O=C(O)Cc1cccc2ccccc12.c1ccc2[nH]ccc2c1

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.71
TRPA1 O75762 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ITGB2 P05107 1/20 0.50
ICAM1 P05362 1/20 0.50
ITGAL P20701 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
AHR P35869 1/20 0.50
ADK P55263 1/20 0.50
CYP1A2 P05177 1/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
KDM4E B2RXH2 4/20 0.44

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
Indole SCHEMBL28646373 0.92 TDP1 (0.60) TDP1TRPA1CA1CA2ITGB2
Indole SCHEMBL28550516 0.91 TDP1 (0.57) TDP1TRPA1CA1CA2ITGB2
Indole-3-Acetic Acid SCHEMBL16197699 0.84 MAPT (0.60) TDP1TRPA1CA1CA2ITGB2
Indole-3-Acetic Acid SCHEMBL31169548 0.84 MAPT (0.60) TDP1TRPA1CA1CA2ITGB2
SCHEMBL35925 0.84 TDP1 (1.00) TDP1CYP1A2KDM4EMEN1KMT2A
SCHEMBL29607554 0.84 TDP1 (1.00) TDP1CYP1A2KDM4EMEN1KMT2A
SCHEMBL27710793 0.84 TDP1 (1.00) TDP1CYP1A2KDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL8440785 0.82 TDP1 (0.96) TDP1CYP1A2KDM4EMEN1KMT2A
Ammonia Solution, Strong SCHEMBL2688886 0.82 TDP1 (0.96) TDP1CYP1A2KDM4EMEN1KMT2A
Ammonia Solution, Strong SCHEMBL21246668 0.82 TDP1 (0.96) TDP1CYP1A2KDM4EMEN1KMT2A

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
CN-115885796-A Planting method for intercropping pachyrhizua angulatus and mesona chinensis benth 梧州市农业科学研究所 2023-04-04 CN disclosed
CN-114766273-A Light-weight-base macadamia nut seedling raising method 广西南亚热带农业科学研究所 2022-07-22 CN disclosed