(-)-Cromakalim

(-)-Cromakalim

SCHEMBL3771007

CC1(C)Oc2ccc(C#N)cc2[C@@H](N2CCCC2=O)C1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 9/20 1.00
ABCC8 Q09428 2/20 1.00
KCNJ11 Q14654 2/20 1.00
KCNJ8 Q15842 2/20 1.00
CYP1A2 P05177 1/20 1.00
CYP2D6 P10635 1/20 1.00
CYP2C9 P11712 1/20 1.00
CYP2C19 P33261 1/20 1.00
LMNA P02545 1/20 1.00
ABCB1 P08183 8/20 0.55
PDE4A P27815 1/20 0.53
PDE4B Q07343 1/20 0.53
PDE4C Q08493 1/20 0.53
PDE4D Q08499 1/20 0.53
KDM4E B2RXH2 1/20 0.50

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
Levcromakalim SCHEMBL122344 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
(-)-Cromakalim SCHEMBL12833 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
(-)-Cromakalim SCHEMBL10644663 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
Levcromakalim SCHEMBL30059152 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
(-)-Cromakalim SCHEMBL24658941 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
Cromakalim SCHEMBL3312760 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
(-)-Cromakalim SCHEMBL25029865 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
(-)-Cromakalim SCHEMBL29345689 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
Cromakalim SCHEMBL30110320 1.00 ABCC9 (1.00) ABCC9ABCC8KCNJ11KCNJ8CYP1A2
SCHEMBL10636063 0.97 ABCC9 (0.94) ABCC9ABCC8KCNJ11KCNJ8CYP1A2

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
WO-2010111518-A1 TREATMENT AND PREVENTION OF WHITE MATTER INJURY WITH KATP CHANNEL ACTIVATORS YALE UNIVERSITY (US) 2010-09-30 WO disclosed