Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 11/20 | 0.51 |
| ▸ | CA12 | O43570 | 10/20 | 0.50 |
| ▸ | CA1 | P00915 | 9/20 | 0.50 |
| ▸ | CA9 | Q16790 | 8/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 2/20 | 0.47 |
| ▸ | CA5A | P35218 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.47 |
| ▸ | P4HB | P07237 | 1/20 | 0.47 |
| ▸ | PDIA4 | P13667 | 1/20 | 0.47 |
| ▸ | PDIA3 | P30101 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL5047747 | 0.90 | CA2 (0.55) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL543667 | 0.90 | CA2 (0.55) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL12128029 | 0.90 | CA2 (0.55) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL16383664 | 0.90 | CA2 (0.55) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL1753653 | 0.90 | CA2 (0.55) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL543668 | 0.90 | CA2 (0.55) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL29709523 | 0.87 | CA2 (0.53) | CYP2D6THRBHSD17B10CA2CA12 | |
| SCHEMBL29709529 | 0.87 | CA2 (0.53) | CYP2D6THRBHSD17B10CA2CA12 | |
| Niacinamide SCHEMBL28724063 | 0.82 | CA2 (0.46) | CA2CA12CA1CA9TSHR | |
| SCHEMBL4461577 | 0.82 | CYP2D6 (0.63) | CYP2D6THRBHSD17B10CA2CA12 |
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-114369129-A | Synthetic method of chlorinated nicotinamide ribose | 宁波新凯生物科技有限公司 | 2022-04-19 | — | — | CN | claimed |
| CN-114369129-A | Synthetic method of chlorinated nicotinamide ribose | 宁波新凯生物科技有限公司 | 2022-04-19 | — | — | CN | disclosed |