Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 4/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.33 |
| ▸ | VEGFA | P15692 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15078792 | 0.87 | LMNA (0.53) | LMNAGBA1CYP1A2CYP2D6CNR1 | |
| SCHEMBL23073289 | 0.83 | KDM1A (0.35) | TSHRTDP1KDM1AL3MBTL1CHEK1 | |
| SCHEMBL23073305 | 0.78 | ADRB2 (0.31) | KDM1AADRB2 | |
| SCHEMBL23073296 | 0.75 | LMNA (0.52) | LMNAGBA1CYP1A2CYP2D6CNR1 | |
| SCHEMBL19175432 | 0.69 | KDM1A (0.44) | LMNAGBA1CYP1A2CYP2D6CNR1 | |
| SCHEMBL15014610 | 0.69 | MAOA (0.53) | SLC6A4KDM1ACHEK1EGLN2ALDH1A1 | |
| SCHEMBL17088062 | 0.66 | ABCB11 (0.53) | LMNACYP2D6SLC6A4KCNH2CYP3A4 | |
| SCHEMBL11525607 | 0.65 | VCAM1 (0.39) | LMNATSHRALDH1A1KDM4EMEN1 | |
| SCHEMBL11685893 | 0.61 | ALDH1A1 (0.37) | CYP1A2CYP2D6KCNH2TSHRTDP1 | |
| SCHEMBL19650807 | 0.60 | LOXL2 (0.57) | SLC6A4KDM1AEGLN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2793872-B1 | COMBINATION OF A COMPOUND HAVING THE ABILITY TO REARRANGE A LYSOSOMAL ENZYME AND AMBROXOL AND/OR A DERIVATIVE OF AMBROXOL | CENTOGENE IP GMBH (DE) | 2021-03-10 | — | — | EP | disclosed |