Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 11/20 | 0.43 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17739709 | 0.88 | NOTUM (0.44) | NOTUMCYP19A1KEAP1HCRTR1HCRTR2 | |
| Iodide SCHEMBL30327029 | 0.84 | CYP19A1 (0.46) | NOTUMCYP19A1KEAP1 | |
| SCHEMBL30332360 | 0.84 | NOTUM (0.42) | NOTUMCYP19A1KEAP1CYP1A2CYP2C9 | |
| SCHEMBL16793221 | 0.84 | NOTUM (0.42) | NOTUMCYP19A1KEAP1CYP1A2CYP2C9 | |
| SCHEMBL20774091 | 0.84 | NOTUM (0.54) | NOTUMCYP19A1KEAP1CYP1A2CYP2C9 | |
| SCHEMBL20230855 | 0.82 | NOTUM (0.47) | NOTUMCYP19A1KEAP1HCRTR1HCRTR2 | |
| SCHEMBL20773632 | 0.81 | NOTUM (0.40) | NOTUMCYP19A1KEAP1 | |
| SCHEMBL1273149 | 0.80 | NOTUM (0.37) | NOTUMCYP19A1KEAP1HCRTR1HCRTR2 | |
| SCHEMBL9706892 | 0.80 | NOTUM (0.39) | NOTUMCYP19A1MEN1LMNAKMT2A | |
| SCHEMBL17539220 | 0.80 | NOTUM (0.50) | NOTUMCYP19A1HCRTR1HCRTR2CYP1A2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104402834-B | 1,4-disubstituted-1,2,3-triazole compound preparation method | 河南师范大学 | 2017-02-22 | — | — | CN | disclosed |
| US-9340578-B2 | Inhibitors targeting human ghrelin O-acyltransferase | SYRACUSE UNIVERSITY (US) | 2016-05-17 | — | — | US | disclosed |
| CN-104402834-A | 1,4-disubstituted-1,2,3-triazole compound preparation method | UNIV HENAN NORMAL | 2015-03-11 | — | — | CN | disclosed |