Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | HTR6 | P50406 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | HRH2 | P25021 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL365839 | 0.86 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1TDP1MEN1KMT2A | |
| SCHEMBL366762 | 0.84 | ALDH1A1 (0.48) | ALDH1A1EGFRL3MBTL1TSHRTDP1 | |
| SCHEMBL365894 | 0.81 | TSHR (0.48) | ALDH1A1EGFRL3MBTL1TSHRTDP1 | |
| SCHEMBL364744 | 0.80 | EGFR (0.39) | ALDH1A1EGFRL3MBTL1TSHRTDP1 | |
| SCHEMBL366754 | 0.79 | TSHR (0.45) | ALDH1A1EGFRL3MBTL1TSHRTDP1 | |
| SCHEMBL366836 | 0.78 | ALDH1A1 (0.50) | ALDH1A1TDP1HTR6MEN1KMT2A | |
| SCHEMBL364887 | 0.78 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1TDP1MEN1KMT2A | |
| SCHEMBL366312 | 0.78 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1TDP1MEN1KMT2A | |
| SCHEMBL366408 | 0.78 | ALDH1A1 (0.52) | ALDH1A1EGFRL3MBTL1TDP1HTR6 | |
| SCHEMBL366765 | 0.78 | TSHR (0.48) | ALDH1A1EGFRL3MBTL1TSHRTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007007-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |