Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.53 |
| ▸ | ERN1 | O75460 | 1/20 | 0.49 |
| ▸ | GRM5 | P41594 | 6/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30214469 | 1.00 | FFAR1 (0.53) | FFAR1ERN1GRM5KCNH2CYP1A2 | |
| SCHEMBL30822819 | 0.90 | FFAR1 (0.46) | FFAR1ERN1GRM5KCNH2 | |
| SCHEMBL30214468 | 0.84 | FFAR1 (0.58) | FFAR1GRM5KCNH2CYP1A2 | |
| SCHEMBL1809895 | 0.84 | FFAR1 (0.58) | FFAR1GRM5KCNH2CYP1A2 | |
| Hydrochloric Acid SCHEMBL19668206 | 0.82 | FFAR1 (0.57) | FFAR1GRM5KCNH2CYP1A2 | |
| SCHEMBL352291 | 0.81 | GRM5 (0.65) | GRM5KCNH2CYP1A2 | |
| SCHEMBL5569770 | 0.81 | GRM5 (0.53) | FFAR1ERN1GRM5KCNH2CYP1A2 | |
| SCHEMBL28950042 | 0.81 | GRM5 (0.56) | FFAR1ERN1GRM5KCNH2 | |
| SCHEMBL14061855 | 0.81 | GRM5 (0.53) | FFAR1ERN1GRM5KCNH2 | |
| SCHEMBL3391907 | 0.81 | MAPT (0.57) | FFAR1ERN1GRM5KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115677740-A | Preparation method of N, O-boron difluoride complex | 华南理工大学 | 2023-02-03 | — | — | CN | disclosed |
| CN-102249831-B | New method for synthesizing 1,2,3-triaryl naphthalene derivatives | UNIV BEIJING CHEMICAL | 2015-04-08 | — | — | CN | disclosed |
| CN-102249831-A | New method for synthesizing 1,2,3-triaryl naphthalene derivatives | UNIV BEIJING CHEMICAL | 2011-11-23 | — | — | CN | disclosed |
| WO-2008125599-A1 | 2-CARBOXY THIOPHENE DERIVATIVES AS ANTI-VIRAL AGENTS | SMITHKLINE BEECHAM CORPORATION (US) | 2008-10-23 | — | — | WO | disclosed |