Tryptophan

Tryptophan

SCHEMBL6274044

N=C(N)NCCC[C@H](N)C(=O)O.N[C@@H](CS)C(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.61

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 0.46
▸ KDM4E B2RXH2 3/20 0.61
▸ MAPT P10636 3/20 0.61
▸ LMNA P02545 2/20 0.61
▸ TSHR P16473 2/20 0.61
▸ BLM P54132 2/20 0.61
▸ PMP22 Q01453 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ MEN1 O00255 1/20 0.61
▸ MPO P05164 1/20 0.61
▸ HIF1A Q16665 1/20 0.61
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ECE1 P42892 5/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ HTR1A P08908 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ HTR2A P28223 1/20 0.45

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 SCHEMBL22495172 1.00 KDM4E (0.61) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL28512622 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Tryptophan SCHEMBL530950 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL27136864 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL28518234 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL28798150 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL20164946 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL1533586 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Tryptophan SCHEMBL27622251 0.95 KDM4E (0.68) KDM4EMAPTLMNATSHRBLM
Dl-Tryptophan SCHEMBL28468559 0.94 KDM4E (0.54) KDM4EMAPTLMNATSHRBLM

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
WO-2005110009-A2 COMPOSITIONS AND METHODS RELATING TO TSP-30a, b, c AND d IMMUNEX CORPORATION (US) 2005-11-24 — — WO disclosed
US-20050054829-A1 Compositions and methods relating to TSP-30a, b, c and d IMMUNEX CORPORATION 2005-03-10 — — US disclosed
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