Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.53 |
| ▸ | MC4R | P32245 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27831528 | 0.82 | SIGMAR1 (0.53) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL2904840 | 0.79 | SIGMAR1 (0.53) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL10640414 | 0.77 | SIGMAR1 (0.52) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL60814 | 0.77 | SIGMAR1 (0.74) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL5870967 | 0.76 | SIGMAR1 (0.50) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL19116976 | 0.76 | SIGMAR1 (0.50) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL13400321 | 0.76 | SIGMAR1 (0.46) | SIGMAR1MC4RLMNAPOLBACHE | |
| SCHEMBL11136071 | 0.75 | SLC6A1 (0.57) | SIGMAR1LMNAALDH1A1KDM4E | |
| SCHEMBL19077902 | 0.75 | SIGMAR1 (0.48) | SIGMAR1MC4RDRD4LMNAPOLB | |
| SCHEMBL12612421 | 0.75 | SIGMAR1 (0.48) | SIGMAR1MC4RDRD4LMNAPOLB |
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-105503924-B | A kind of synthesis N replaces the method for the borate of 1,2,3,6 tetrahydropyridine 5 | 沧州普瑞东方科技有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-105503924-A | Method for synthesizing N-substitute-1, 2, 3, 6-tetrahydropyridine-5-boric acid ester | CANGZHOU PURUIDONGFANG TECH CO LTD | 2016-04-20 | — | — | CN | disclosed |