Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.76 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.60 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.50 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.50 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.50 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.50 |
| ▸ | CXCL8 | P10145 | 3/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.48 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.48 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.48 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.48 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.48 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.48 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | STING1 | Q86WV6 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL69234 | 1.00 | TDP1 (0.76) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL21585563 | 0.93 | TDP1 (0.68) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL69027 | 0.90 | TDP1 (0.69) | TDP1AKR1B1CXCL8KDM4EMAPT | |
| SCHEMBL29732929 | 0.90 | TDP1 (0.69) | TDP1AKR1B1CXCL8KDM4EMAPT | |
| SCHEMBL6738986 | 0.89 | AKR1B1 (0.67) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL9192502 | 0.89 | TDP1 (0.63) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL9193877 | 0.88 | TDP1 (0.61) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL22622349 | 0.88 | TDP1 (0.61) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL3285169 | 0.88 | TDP1 (0.61) | TDP1AKR1B1DUSP3PTPN5PTPN11 | |
| SCHEMBL8115692 | 0.88 | TDP1 (0.61) | TDP1AKR1B1DUSP3PTPN5PTPN11 |
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-108546224-B | Process for the manufacture of nitriles and their corresponding amines | 中国石化扬子石油化工有限公司 | 2022-05-27 | — | — | CN | claimed |
| CN-108546224-B | Process for the manufacture of nitriles and their corresponding amines | 中国石化扬子石油化工有限公司 | 2022-05-27 | — | — | CN | disclosed |