Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K4 | P45985 | 5/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | IDO1 | P14902 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ALPL | P05186 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TTK | P33981 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.40 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27831832 | 0.81 | KDM4E (0.48) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| Tert-Butyl Formate SCHEMBL27926204 | 0.81 | KDM4E (0.44) | KDM4EALDH1A1GAAHPGDNPC1 | |
| Tert-Butyl Formate SCHEMBL28124612 | 0.74 | KDM4E (0.62) | KDM4EIDO1ALDH1A1ALPLGAA | |
| Tert-Butyl Formate SCHEMBL27819536 | 0.74 | CYP1A2 (0.54) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| SCHEMBL27811452 | 0.74 | MAP2K4 (0.52) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| Tert-Butyl Formate SCHEMBL27811446 | 0.74 | PDPK1 (0.57) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| Tert-Butyl Formate SCHEMBL28019187 | 0.73 | CYP1A2 (0.41) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| Tert-Butyl Formate SCHEMBL28740575 | 0.73 | CYP1A2 (0.41) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| Tert-Butyl Formate SCHEMBL27831787 | 0.73 | CYP1A2 (0.41) | MAP2K4KDM4EIDO1ALDH1A1ALPL | |
| SCHEMBL11903949 | 0.72 | MAP2K4 (0.63) | MAP2K4KDM4EIDO1ALDH1A1ALPL |
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-102089302-A | Nitrogenated bicyclic heterocyclic compound | ASAHI KASEI PHARMA CORP | 2011-06-08 | — | — | CN | disclosed |