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Sugi Predict / Compounds / Tyrosine

Tyrosine

Tyrosine

SCHEMBL6253686

CC(C)C[C@H](N)C(=O)O.CC(C)C[C@H](N)C(=O)O.CC(C)C[C@H](N)C(=O)O.CC(C)[C@H](N)C(=O)O.CC[C@H](C)[C@H](N)C(=O)O.CC[C@H](C)[C@H](N)C(=O)O.C[C@H](N)C(=O)O.NC(=O)CC[C@H](N)C(=O)O.NC(=O)CC[C@H](N)C(=O)O.NC(=O)C[C@H](N)C(=O)O.NC(=O)C[C@H](N)C(=O)O.NCC(=O)O.NCC(=O)O.NCC(=O)O.N[C@@H](CO)C(=O)O.N[C@@H](CO)C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O.N[C@@H](Cc1ccc(O)cc1)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC5A2

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

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 2/20 0.38
▸ KISS1R Q969F8 8/20 0.34
▸ KDM1A O60341 2/20 0.33
▸ NPY1R P25929 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ KDM5A P29375 1/20 0.32
▸ KDM1B Q8NB78 1/20 0.32

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
Tyrosine SCHEMBL28490008 0.99 REN (0.39) RENKISS1RKDM1ANPY1RMAOB
Tyrosine SCHEMBL28498362 0.92 F2 (0.38) RENNPY1R
Tyrosine SCHEMBL294953 0.91 REN (0.38) RENKISS1RKDM1ANPY1R
Tyrosine SCHEMBL5151728 0.89 REN (0.36) RENKISS1RNPY1R
Tyrosine SCHEMBL29176062 0.88 REN (0.39) REN
Tyrosine SCHEMBL10379802 0.88 SLC7A5 (0.38) REN
Tryptophan SCHEMBL8412518 0.87 KISS1R (0.39) KISS1R
Tyrosine SCHEMBL20855327 0.87 REN (0.35) RENNPY1R
Tyrosine SCHEMBL25373485 0.87 SLC6A2 (0.36) REN
Tyrosine SCHEMBL28760425 0.86 VIPR2 (0.43) KDM1ANPY1RMAOBKDM5AKDM1B

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-1166650-B1 Cheese flavor SYMRISE GMBH & CO KG (DE) 2005-09-07 — — EP disclosed
US-20020034570-A1 Cheese flavoring SYMRISE GMBH & CO. KG (DE) 2002-03-21 — — US disclosed
EP-1166650-A2 Cheese flavor HAARMANN & REIMER GMBH (DE) 2002-01-02 — — EP disclosed