Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.58 |
| ▸ | GRM5 | P41594 | 5/20 | 0.55 |
| ▸ | APP | P05067 | 1/20 | 0.55 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | THPO | P40225 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL1809895 | 1.00 | FFAR1 (0.58) | FFAR1GRM5APPGRM4KCNH2 | |
| Hydrochloric Acid SCHEMBL19668206 | 0.98 | FFAR1 (0.57) | FFAR1GRM5APPGRM4KCNH2 | |
| SCHEMBL27965841 | 0.90 | FFAR1 (0.55) | FFAR1GRM5GRM4KCNH2 | |
| SCHEMBL352291 | 0.88 | GRM5 (0.65) | GRM5KCNH2CYP1A2 | |
| SCHEMBL31673060 | 0.87 | GRM5 (0.55) | FFAR1GRM5KCNH2CYP1A2 | |
| SCHEMBL7873393 | 0.84 | FFAR1 (0.49) | FFAR1GRM5KCNH2CYP1A2 | |
| SCHEMBL14061855 | 0.84 | GRM5 (0.53) | FFAR1GRM5KCNH2 | |
| SCHEMBL5569770 | 0.84 | GRM5 (0.53) | FFAR1GRM5KCNH2CYP1A2 | |
| SCHEMBL28950042 | 0.84 | GRM5 (0.56) | FFAR1GRM5KCNH2 | |
| SCHEMBL4750207 | 0.84 | FFAR1 (0.53) | FFAR1GRM5KCNH2CYP1A2 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118290328-A | Hydrocarbon pyridine and preparation method thereof | 北京师范大学 | 2024-07-05 | — | — | CN | disclosed |
| CN-115677740-A | Preparation method of N, O-boron difluoride complex | 华南理工大学 | 2023-02-03 | — | — | CN | disclosed |