Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.47 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | NR2E1 | Q9Y466 | 2/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.43 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9835931 | 0.82 | KDM4E (0.66) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| Cyclomethyltryptophan SCHEMBL29535380 | 0.78 | KDM4E (0.71) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| Cyclomethyltryptophan SCHEMBL7889282 | 0.78 | KDM4E (0.71) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| Cyclomethyltryptophan SCHEMBL416557 | 0.78 | KDM4E (0.71) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| Cyclomethyltryptophan SCHEMBL416558 | 0.78 | KDM4E (0.71) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6609244 | 0.78 | NR2E1 (0.57) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| Cyclomethyltryptophan SCHEMBL10642614 | 0.77 | KDM4E (0.69) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| Cyclomethyltryptophan SCHEMBL28419799 | 0.77 | KDM4E (0.69) | KDM4ECYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL7525817 | 0.75 | KDM4E (0.62) | KDM4ECYP2D6CYP2C19HSD17B10ALDH1A1 | |
| SCHEMBL7519979 | 0.75 | CYP2D6 (0.67) | KDM4ECYP2D6CYP2C19HSD17B10ALDH1A1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0891187-B1 | USE OF DERIVATIVES OF TETRAHYDRO-BETA-CARBOLINES AS ANTIMETASTATIC AGENTS | HOFFMANN LA ROCHE (CH) | 2002-01-30 | — | — | EP | claimed |
| EP-0736039-B1 | COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES | NOVO NORDISK AS (DK) | 2000-10-25 | — | — | EP | claimed |
| EP-2086993-B1 | MICHAEL SYSTEMS AS TRANSGLUTAMINASE INHIBITORS | ZEDIRA GMBH (DE) | 2015-03-11 | — | — | EP | disclosed |
| EP-0861236-B2 | CYCLIC AND HETEROCYCLIC N-SUBSTITUTED ALPHA-IMINOHYDROXAMIC AND CARBOXYLIC ACIDS | SANOFI AVENTIS DEUTSCHLAND (DE) | 2006-08-16 | — | — | EP | disclosed |
| EP-0703786-B1 | USE OF NONA- AND DECAPEPTIDES IN THE PREPARATION OF A DRUG FOR THE TREATMENT OF AIDS | ZENTARIS AG (DE) | 2002-02-13 | — | — | EP | disclosed |
| EP-0861236-B1 | CYCLIC AND HETEROCYCLIC N-SUBSTITUTED ALPHA-IMINOHYDROXAMIC AND CARBOXYLIC ACIDS | HOECHST AG (DE) | 2002-02-13 | — | — | EP | disclosed |
| EP-0446706-A2 | Peptides with tachykinin-agonistic or -antagonistic activity | MERCK PATENT GmbH (DE) | 1991-09-18 | — | — | EP | disclosed |
| EP-0116842-A2 | Amino-acids derivatives, process for their preparation and their use | BOEHRINGER INGELHEIM KG (DE) | 1984-08-29 | — | — | EP | disclosed |