Lysine

Lysine

SCHEMBL8585292

CC(C)[C@H](N)C(=O)O.C[C@@H](O)[C@H](N)C(=O)O.C[C@H](N)C(=O)OC(=O)[C@@H](N)CS.NCCCC[C@H](N)C(=O)O.N[C@@H](CS)C(=O)O.N[C@H](Cc1ccc(OC(=O)[C@@H](N)Cc2ccc(OC(=O)[C@H](N)Cc3c[nH]c4ccccc34)cc2)cc1)C(=O)O

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 9/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MPO P05164 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ BLM P54132 1/20 0.42
▸ PMP22 Q01453 1/20 0.42
▸ HIF1A Q16665 1/20 0.42
▸ MC4R P32245 2/20 0.39
▸ MC5R P33032 1/20 0.39
▸ MC3R P41968 1/20 0.39
▸ TACR1 P25103 2/20 0.38
▸ HSP90AA1 P07900 1/20 0.38
▸ HSP90AB1 P08238 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ PLA2G2A P14555 1/20 0.38

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
Valine SCHEMBL8584754 0.97 GHSR (0.43) GHSRMEN1KMT2AKDM4ELMNA
Valine SCHEMBL8434539 0.97 GHSR (0.43) GHSRMEN1KMT2AKDM4ELMNA
D-Tryptophan SCHEMBL8585295 0.86 KDM4E (0.48) GHSRMEN1KMT2AKDM4ELMNA
D-Tryptophan SCHEMBL8434542 0.86 KDM4E (0.49) GHSRMEN1KMT2AKDM4ELMNA
D-Tryptophan SCHEMBL8584759 0.86 KDM4E (0.49) GHSRMEN1KMT2AKDM4ELMNA
Methionine SCHEMBL6244204 0.82 MEN1 (0.46) GHSRMEN1KMT2AKDM4ELMNA
Threonine SCHEMBL9220826 0.81 KDM4E (0.55) GHSRMEN1KMT2AKDM4ELMNA
Tryptophan SCHEMBL7763177 0.81 KDM4E (0.60) GHSRMEN1KMT2AKDM4ELMNA
Phenylalanine SCHEMBL7341867 0.80 MEN1 (0.50) GHSRMEN1KMT2AKDM4ELMNA
Dl-Tryptophan SCHEMBL9220819 0.80 KDM4E (0.65) GHSRMEN1KMT2AKDM4ELMNA

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
EP-0833646-A4 MULTI-TYROSINATED SOMATOSTATIN ANALOGS UNIV LOUISIANA STATE MED (US) 1998-05-27 — — EP disclosed
EP-0833646-A1 MULTI-TYROSINATED SOMATOSTATIN ANALOGS The Administrators of The Tulane Educational Fund (US) 1998-04-08 — — EP disclosed
WO-1996039161-A1 MULTI-TYROSINATED SOMATOSTATIN ANALOGS THE ADMINISTRATORS OF THE TULANE EDUCATIONAL FUND (US) 1996-12-12 — — WO disclosed
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