Tryptophan

Tryptophan

SCHEMBL28205930

C[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.N=C(N)NCCC[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.53

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
▸ KDM4E B2RXH2 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ TSHR P16473 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ LMNA P02545 1/20 0.53
▸ MPO P05164 1/20 0.53
▸ BLM P54132 1/20 0.53
▸ PMP22 Q01453 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ GHSR Q92847 4/20 0.53
▸ MC4R P32245 2/20 0.49
▸ MC5R P33032 1/20 0.49
▸ MC3R P41968 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ ALOX15 P16050 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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 SCHEMBL27709285 0.97 KDM4E (0.57) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL28366886 0.97 KDM4E (0.57) KDM4EMEN1MAPTTSHRKMT2A
Tryptophan SCHEMBL27641188 0.97 KDM4E (0.57) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL28250969 0.94 KDM4E (0.54) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL27093065 0.93 KDM4E (0.61) KDM4EMEN1MAPTTSHRKMT2A
Tryptophan SCHEMBL27671666 0.93 KDM4E (0.61) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL28466764 0.93 KDM4E (0.61) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL22587382 0.93 KDM4E (0.61) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL27660745 0.92 KMT2A (0.63) KDM4EMEN1MAPTTSHRKMT2A
Dl-Tryptophan SCHEMBL28861116 0.91 KMT2A (0.58) KDM4EMEN1MAPTTSHRKMT2A

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
CN-107759664-A A kind of micromolecule polypeptide AKK10 and its application 中国科学院新疆理化技术研究所 2018-03-06 — — CN disclosed
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