Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.40 |
| ▸ | SELE | P16581 | 2/20 | 0.40 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20509797 | 0.81 | ICAM1 (0.43) | KDM4EALDH1A1HPGDHTTNCOA1 | |
| SCHEMBL26339565 | 0.80 | HTT (0.43) | KDM4EALDH1A1HPGDCASP1HTT | |
| SCHEMBL10857605 | 0.80 | DHODH (0.41) | KDM4EALDH1A1HPGDHTTNCOA1 | |
| SCHEMBL26337401 | 0.78 | MAPK1 (0.44) | KDM4EALDH1A1GAAHSD17B10HPGD | |
| SCHEMBL30753169 | 0.78 | MAPK1 (0.44) | KDM4EALDH1A1GAAHSD17B10HPGD | |
| SCHEMBL29599494 | 0.77 | TSHR (0.46) | KDM4EALDH1A1GLAGAAHSD17B10 | |
| SCHEMBL826816 | 0.77 | TSHR (0.46) | KDM4EALDH1A1GLAGAAHSD17B10 | |
| SCHEMBL27739316 | 0.74 | KDM4E (0.41) | KDM4EALDH1A1GLAGAAHSD17B10 | |
| SCHEMBL89040 | 0.73 | ATM (0.52) | KDM4EALDH1A1GLAGAAHSD17B10 | |
| SCHEMBL6980834 | 0.72 | CA12 (0.42) | KDM4EALDH1A1HSD17B10HPGDKMT2A |
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-105339371-A | Thieno[3,2-d]pyrimidine-6-carboxamides and analogues as sirtuin modulators | GLAXOSMITHKLINE LLC | 2016-02-17 | — | — | CN | disclosed |