Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FABP4 | P15090 | 5/20 | 0.54 |
| ▸ | FABP3 | P05413 | 4/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.51 |
| ▸ | FABP5 | Q01469 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAT2A | P31153 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL13361709 | 0.89 | FABP4 (0.52) | FABP4FABP3ESR1ESR2FABP5 | |
| SCHEMBL4430115 | 0.83 | DPP4 (0.62) | FABP4FABP3ESR1ESR2FABP5 | |
| SCHEMBL3319793 | 0.83 | ADORA2A (0.56) | FABP4FABP3MAPTKDM4EADORA2A | |
| SCHEMBL8956411 | 0.81 | MAPT (0.57) | FABP4FABP3ESR1ESR2FABP5 | |
| SCHEMBL28041579 | 0.80 | DHODH (0.49) | MAPTKDM4EADORA2AMAPK1HTT | |
| SCHEMBL28041367 | 0.80 | KDM4E (0.50) | MAPTKDM4EMAPK1NPC1RAB9A | |
| SCHEMBL29059116 | 0.79 | ESR1 (0.67) | FABP4FABP3ESR1ESR2FABP5 | |
| SCHEMBL28041598 | 0.78 | KDM4E (0.56) | ESR1ESR2MAPTKDM4EGAA | |
| SCHEMBL9161172 | 0.78 | ALDH1A1 (0.52) | FABP4FABP3ESR1ESR2FABP5 | |
| SCHEMBL27956658 | 0.77 | ESR1 (0.82) | FABP4FABP3ESR1ESR2FABP5 |
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-104086485-B | Prepare the method for poly-substituted quinoline type aromatic ring pyridine derivate | TSINGHUA UNIVERSITY (CN) | 2016-03-30 | — | — | CN | disclosed |