Butylamine

Butylamine

SCHEMBL30153333

CCCCN.COc1ccc(/C=C(/C(=O)O)c2cc(OC)c(OC)c(OC)c2)cc1O

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 15/20 0.60
TUBB4A P04350 9/20 0.60
TUBB P07437 9/20 0.60
TUBA3C P0DPH7 9/20 0.60
TUBA1B P68363 9/20 0.60
TUBA4A P68366 9/20 0.60
TUBB4B P68371 9/20 0.60
TUBB3 Q13509 9/20 0.60
TUBB2A Q13885 9/20 0.60
TUBB8 Q3ZCM7 9/20 0.60
TUBA3E Q6PEY2 9/20 0.60
TUBA1A Q71U36 9/20 0.60
TUBA1C Q9BQE3 9/20 0.60
TUBB6 Q9BUF5 9/20 0.60
TUBB2B Q9BVA1 9/20 0.60
AKR1C2 P52895 1/20 0.54
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
BACE1 P56817 1/20 0.47

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
Glycine SCHEMBL30543145 0.89 TUBB1 (0.64) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL15675107 0.89 TUBB1 (0.72) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5700860 0.89 TUBB1 (0.72) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL28910695 0.84 TUBB1 (0.61) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27176081 0.84 TUBB1 (0.61) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL15695525 0.82 TUBB1 (0.64) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27176082 0.79 AKR1C2 (0.65) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL30267516 0.78 AKR1C2 (0.71) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27176088 0.78 AKR1C2 (0.71) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL27176080 0.78 AKR1C2 (0.62) TUBB1TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116492323-B New application of styreneic acid compound 广州安好医药科技有限公司 2024-02-02 CN disclosed
CN-116492323-A New application of styreneic acid compound 广州安好医药科技有限公司 2023-07-28 CN disclosed
WO-2023019687-A1 ION-SENSITIVE OPHTHALMIC IN-SITU GEL, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 海南鑫开源医药科技有限公司 2023-02-23 WO disclosed