Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 8/20 | 1.00 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 1.00 |
| ▸ | IDO1 | P14902 | 7/20 | 0.64 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.64 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.51 |
| ▸ | METAP1 | P53582 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL29539786 | 1.00 | METAP2 (1.00) | METAP2SIRT3IDO1KEAP1CYP2A6 | |
| Ethoxycarbonyl Group SCHEMBL28058501 | 0.82 | METAP2 (0.68) | METAP2SIRT3IDO1KEAP1CYP2A6 | |
| SCHEMBL8221447 | 0.79 | METAP2 (1.00) | METAP2SIRT3IDO1KEAP1METAP1 | |
| SCHEMBL5025520 | 0.77 | IDO1 (1.00) | METAP2SIRT3IDO1KEAP1METAP1 | |
| SCHEMBL8664138 | 0.77 | METAP2 (0.95) | METAP2SIRT3IDO1KEAP1METAP1 | |
| SCHEMBL29419014 | 0.72 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP1A2CYP3A4KDM4E | |
| SCHEMBL30473120 | 0.72 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP1A2CYP3A4KDM4E | |
| SCHEMBL120088 | 0.72 | CYP2A6 (1.00) | CYP2A6ALDH1A1CYP1A2CYP3A4KDM4E | |
| SCHEMBL446537 | 0.72 | METAP2 (0.56) | METAP2SIRT3CYP2A6ALDH1A1CYP1A2 | |
| SCHEMBL29960290 | 0.72 | METAP2 (0.56) | METAP2SIRT3CYP2A6ALDH1A1CYP1A2 |
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-105541796-A | Synthetic method of NH-1,2,3-triazole bipyridine compounds | WUHAN INST TECHNOLOGY | 2016-05-04 | — | — | CN | disclosed |