Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 5/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.32 |
| ▸ | VEGFA | P15692 | 1/20 | 0.32 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.31 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23073295 | 0.83 | LMNA (0.39) | KDM1ATSHRL3MBTL1CHEK1VEGFA | |
| SCHEMBL15078792 | 0.70 | LMNA (0.53) | KDM1ATSHRCHEK1PABPC1TDP1 | |
| SCHEMBL28384865 | 0.70 | TTR (0.38) | TSHRALDH1A1KDM4EMEN1GAA | |
| SCHEMBL15014610 | 0.68 | MAOA (0.53) | KDM1ACHEK1EGLN2LTA4HALDH1A1 | |
| SCHEMBL11617778 | 0.65 | KDM4E (0.44) | TSHRPABPC1ALDH1A1KDM4EMEN1 | |
| SCHEMBL23073305 | 0.63 | ADRB2 (0.31) | KDM1A | |
| SCHEMBL19175432 | 0.62 | KDM1A (0.44) | KDM1ATSHREGLN2ALDH1A1KDM4E | |
| SCHEMBL3440379 | 0.62 | MEN1 (0.51) | TSHRL3MBTL1LTA4HKDM4EMEN1 | |
| SCHEMBL19650807 | 0.60 | LOXL2 (0.57) | KDM1AEGLN2MEN1KMT2A | |
| SCHEMBL26599015 | 0.59 | KDM4E (0.36) | KDM1APABPC1KDM4EMEN1HTT |
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 |