Tryptophan

Tryptophan

SCHEMBL18171550

CSCC[C@H](N)C(=O)O.N=C(N)NC(CC[C@H](N)C(=O)O)N[C@@H](CC(N)=O)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACE

The experimentally established mechanism targets of Tryptophan. 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
▸ ACE known ✓ P12821 1/20 0.39
▸ CTSC P53634 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ MPO P05164 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ PMP22 Q01453 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ MMP1 P03956 2/20 0.41
▸ KISS1R Q969F8 2/20 0.40
▸ ERAP2 Q6P179 2/20 0.39
▸ ERAP1 Q9NZ08 2/20 0.39
▸ LNPEP Q9UIQ6 2/20 0.39
▸ CCKBR P32239 1/20 0.39
▸ PRMT1 Q99873 1/20 0.39
▸ ALOX15 P16050 1/20 0.39

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
Dl-Tryptophan SCHEMBL28221613 0.90 CTSC (0.54) CTSCMEN1KMT2AKDM4ELMNA
Tryptophan SCHEMBL18171551 0.90 CTSC (0.54) CTSCMEN1KMT2AKDM4ELMNA
Tryptophan SCHEMBL6246810 0.84 CTSC (0.54) CTSCMEN1KMT2AKDM4ELMNA
Tryptophan SCHEMBL6244660 0.83 CTSC (0.52) CTSCMEN1KMT2AKDM4ELMNA
Tryptophan SCHEMBL6247563 0.83 CTSC (0.52) CTSCMEN1KMT2AKDM4ELMNA
Tryptophan SCHEMBL23698367 0.82 CTSC (0.51) CTSCMEN1KMT2AKDM4ELMNA
Dl-Tryptophan SCHEMBL28798150 0.82 KDM4E (0.68) CTSCMEN1KMT2AKDM4ELMNA
Dl-Tryptophan SCHEMBL1533586 0.82 KDM4E (0.68) CTSCMEN1KMT2AKDM4ELMNA
Dl-Tryptophan SCHEMBL20164946 0.82 KDM4E (0.68) CTSCMEN1KMT2AKDM4ELMNA
Dl-Tryptophan SCHEMBL28512622 0.82 KDM4E (0.68) CTSCMEN1KMT2AKDM4ELMNA

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-2016169239-A1 5 PEPTIDE RELATED WITH INTEGRIN RECEPTOR ΑVΒ3 中国药科大学 2016-10-27 — — WO disclosed
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