Salicylic Acid

Salicylic Acid

SCHEMBL28181702

CC1CSCC(C)(C)C1.O=C(O)c1ccccc1O

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHE

The experimentally established mechanism targets of Salicylic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
LMNA P02545 4/20 0.49
CYP3A4 P08684 2/20 0.49
CYP2C9 P11712 2/20 0.49
CYP2C19 P33261 2/20 0.49
CYP1A2 P05177 1/20 0.49
HPGD P15428 5/20 0.49
KDM4E B2RXH2 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
HMGB1 P09429 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
NAPRT Q6XQN6 1/20 0.49
CA14 Q9ULX7 1/20 0.49
CYP2D6 P10635 2/20 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
Salicylic Acid SCHEMBL3397874 0.78 ALDH1A1 (0.58) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Salicylic Acid SCHEMBL22022712 0.77 ALDH1A1 (0.50) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Salicylic Acid SCHEMBL2898273 0.76 ALDH1A1 (0.55) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Salicylic Acid SCHEMBL9813624 0.74 ALDH1A1 (0.55) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Salicylic Acid SCHEMBL980591 0.72 ALDH1A1 (0.95) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
Salicylic Acid SCHEMBL5954312 0.72 ALDH1A1 (0.95) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
Salicylic Acid SCHEMBL29386727 0.72 ALDH1A1 (0.95) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
Salicylic Acid SCHEMBL980590 0.72 ALDH1A1 (0.95) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2
Salicylic Acid SCHEMBL28160119 0.70 ALDH1A1 (0.62) ALDH1A1LMNACYP3A4CYP2C9CYP2C19
Salicylic Acid SCHEMBL8029424 0.70 ALDH1A1 (0.90) ALDH1A1LMNAHPGDKDM4ESMN1; SMN2

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-107255685-A The high performance liquid chromatography of ultraviolet absorber in a kind of detection cosmetics 厦门鉴科检测技术有限公司 2017-10-17 CN disclosed