Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | GRM5 | P41594 | 1/20 | 0.50 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12524683 | 0.86 | ATM (0.53) | ATMMAPTGRM5RAB9ACYP11B1 | |
| SCHEMBL31287098 | 0.86 | ATM (0.53) | ATMMAPTGRM5SIRT2SIRT1 | |
| SCHEMBL28075208 | 0.84 | ATM (0.48) | ATMMAPTGRM5SIRT2SIRT1 | |
| SCHEMBL23167202 | 0.83 | ATM (0.56) | ATMMAPTGRM5SIRT2SIRT1 | |
| SCHEMBL14004766 | 0.82 | ATM (0.49) | ATMMAPTGRM5SIRT2SIRT1 | |
| SCHEMBL26154762 | 0.82 | ATM (0.49) | ATMMAPTGRM5SIRT2SIRT1 | |
| SCHEMBL25274051 | 0.82 | ATM (0.46) | ATMMAPTGRM5SIRT2SIRT1 | |
| SCHEMBL2809253 | 0.82 | MAPT (0.59) | ATMMAPTRAB9AALDH1A1TDP1 | |
| SCHEMBL38987 | 0.82 | MAPT (0.59) | ATMMAPTRAB9AALDH1A1TDP1 | |
| SCHEMBL31286974 | 0.81 | ATM (0.48) | ATMMAPTGRM5RAB9AALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104024226-B | Novel nicotinamide derivative or salt thereof | FUJIFILM CORP. (JP) | 2016-06-01 | — | — | CN | disclosed |