Zinc Ion

Zinc Ion

SCHEMBL3689488

CC1CCCCC1NC(=O)CC(CC(=O)NC1CCCCC1C)C(=O)NC1CCCCC1C.CCCCCCC(O)CCCCCCCCCCC(=O)[O-].CCCCCCC(O)CCCCCCCCCCC(=O)[O-].[Zn+2]

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.44
GPR84 Q9NQS5 1/20 0.43
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
FAAH O00519 2/20 0.37
FFAR4 Q5NUL3 1/20 0.37
FFAR1 O14842 1/20 0.37
TRPV1 Q8NER1 4/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 2/20 0.35
MMP1 P03956 2/20 0.35
MMP3 P08254 2/20 0.35
USP2 O75604 1/20 0.35
LTB4R Q15722 1/20 0.35
CCR2 P41597 1/20 0.34

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
SCHEMBL3687278 0.98 NFKB1 (0.47) NFKB1GPR84ALDH1A1KMT2AFAAH
SCHEMBL3690998 0.98 NFKB1 (0.44) NFKB1GPR84ALDH1A1KMT2AFAAH
SCHEMBL3692052 0.98 NFKB1 (0.44) NFKB1GPR84ALDH1A1KMT2AFAAH
Potassium Ion SCHEMBL3689819 0.98 NFKB1 (0.44) NFKB1GPR84ALDH1A1KMT2AFAAH
Stearic Acid SCHEMBL3696710 0.94 TRPV1 (0.39) KMT2ATRPV1CNR1CNR2USP2
Stearic Acid SCHEMBL3687284 0.92 TRPV1 (0.39) KMT2ATRPV1CNR1CNR2USP2
Stearic Acid SCHEMBL3686276 0.92 TRPV1 (0.39) KMT2ATRPV1CNR1CNR2USP2
Stearic Acid SCHEMBL3691439 0.92 TRPV1 (0.39) KMT2ATRPV1CNR1CNR2USP2
Stearic Acid SCHEMBL3690236 0.92 TRPV1 (0.39) KMT2ATRPV1CNR1CNR2USP2
Zinc Ion SCHEMBL3692705 0.82 NFKB1 (0.46) NFKB1GPR84ALDH1A1KMT2AFAAH

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
US-7723413-B2 Method and composition for control of crystallization rate of polyolefin resin, resin composition and resin molding NEW JAPAN CHEMICAL CO., LTD. (JP) 2010-05-25 US disclosed
US-20070142514-A1 Method and composition for control of crystallization rate of polyolefin resin, resin composition and resin molding NEW JAPAN CHEMICAL CO., LTD. (JP) 2007-06-21 US disclosed