Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | MMP2 | P08253 | 3/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | CCR1 | P32246 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CCR5 | P51681 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL16825442 | 0.87 | MMP2 (0.44) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL28707626 | 0.80 | MMP2 (0.48) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL3145084 | 0.77 | RAB9A (0.53) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL5459975 | 0.77 | MAPT (0.48) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL27810285 | 0.77 | MMP2 (0.44) | KDM4EMMP2MMP9TSHRMAPT | |
| Hno SCHEMBL28954421 | 0.75 | KDM4E (0.50) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL25802198 | 0.75 | KDM4E (0.45) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL13447596 | 0.75 | KDM4E (0.45) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL643810 | 0.74 | KDM4E (0.54) | KDM4EMMP2MMP9TSHRMAPT | |
| SCHEMBL3969185 | 0.74 | KDM4E (0.54) | KDM4EMMP2MMP9TSHRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-3083584-A1 | NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS | Sunshine Lake Pharma Co., Ltd. (CN) | 2016-10-26 | — | — | EP | disclosed |
| WO-2015090232-A1 | NITROGENOUS HETEROCYCLIC DERIVATIVES AND THEIR APPLICATION IN DRUGS | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2015-06-25 | — | — | WO | disclosed |