Sugi Predict

Sugi Predict / Compounds / Tryptophan

Tryptophan

Tryptophan

SCHEMBL6437302

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.CSCC[C@H](N)C(=O)O.C[C@@H](O)[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O.N[C@@H](CO)C(=O)O.N[C@@H](Cc1c[nH]c2ccccc12)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

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

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 13)

geneUniProtsupporting neighboursconfidence
▸ GHSR Q92847 4/20 0.41
▸ GLP1R P43220 3/20 0.36
▸ GCGR P47871 1/20 0.36
▸ GIPR P48546 1/20 0.36
▸ CCKBR P32239 1/20 0.35
▸ KISS1R Q969F8 1/20 0.35
▸ PTH1R Q03431 5/20 0.35
▸ TACR1 P25103 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ IL1RN P18510 1/20 0.35
▸ ERAP2 Q6P179 1/20 0.35
▸ TLR2 O60603 1/20 0.35

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
D-Tryptophan SCHEMBL27533489 0.98 GHSR (0.41) GHSRGLP1RGCGRGIPRCCKBR
Tryptophan SCHEMBL28755030 0.97 GHSR (0.42) GHSRGLP1RGCGRGIPRCCKBR
Tryptophan SCHEMBL27620479 0.95 GHSR (0.44) GHSRGLP1RGCGRGIPRCCKBR
Tryptophan SCHEMBL27651679 0.94 GHSR (0.38) GHSRGLP1RGCGRCCKBR
Tryptophan SCHEMBL6438435 0.91 GLP1R (0.40) GLP1RGCGR
Tryptophan SCHEMBL10537195 0.91 GHSR (0.41) GHSRGLP1RGCGRGIPRKISS1R
Tryptophan SCHEMBL6563945 0.91 GLP1R (0.41) GLP1RGCGR
Tryptophan SCHEMBL6480796 0.90 MEN1 (0.41) CCKBRMEN1KMT2A
Dl-Tryptophan SCHEMBL27639636 0.89 MEN1 (0.38) GHSRMEN1KMT2AERAP2
Tryptophan SCHEMBL8346942 0.89 MEN1 (0.42) GHSRMEN1KMT2A

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
EP-1562579-A1 THERAPEUTIC DELIVERY OF CARBON MONOXIDE Hemocorm Limited (GB) 2005-08-17 — — EP claimed
WO-2004045599-A1 THERAPEUTIC DELIVERY OF CARBON MONOXIDE HEMOCORM LIMITED (GB) 2004-06-03 — — WO claimed