Indole

Indole

SCHEMBL28550516

O=C(O)Cc1cccc2[nH]ccc12.c1ccc2[nH]ccc2c1

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.57
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
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
AKR1B1 P15121 1/20 0.46
ALDH1A1 P00352 3/20 0.46

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 SCHEMBL28979810 0.91 TDP1 (0.71) TDP1TRPA1CA1CA2ITGB2
SCHEMBL4309213 0.91 GRIN2D (0.54) TDP1AHRGRIN2DGRIN3BGRIN1
SCHEMBL30009880 0.91 GRIN2D (0.54) TDP1AHRGRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL1374957 0.89 GRIN2D (0.53) TDP1AHRGRIN2DGRIN3BGRIN1
Indole-3-Acetic Acid SCHEMBL31169548 0.87 MAPT (0.60) TDP1TRPA1CA1CA2ITGB2
Indole-3-Acetic Acid SCHEMBL16197699 0.87 MAPT (0.60) TDP1TRPA1CA1CA2ITGB2
Indole SCHEMBL28646373 0.84 TDP1 (0.60) TDP1TRPA1CA1CA2ITGB2
SCHEMBL8186005 0.82 GRIN2D (0.43) TDP1GRIN2DGRIN3BGRIN1GRIN2A
Phenylacetic Acid SCHEMBL26643888 0.80 AKR1B1 (0.59) TRPA1CA1CA2ITGB2ICAM1
SCHEMBL7674165 0.78 MAPT (0.64) TDP1AHRGRIN2DGRIN3BGRIN1

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-112673096-A Plants containing elite event EE-GM4, and methods and kits for identifying said event in biological samples, and treatment thereof 巴斯夫农业种子解决方案美国有限责任公司 2021-04-16 CN disclosed
CN-112673095-A Plants containing elite event EE-GM5, and methods and kits for identifying said event in biological samples, and treatment thereof 巴斯夫农业种子解决方案美国有限责任公司 2021-04-16 CN disclosed