Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.46 |
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | PDE4A | P27815 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.41 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.41 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9877591 | 0.81 | ALDH1A1 (0.49) | ALDH1A1HPGDNPSR1MCOLN3PDE2A | |
| SCHEMBL9877681 | 0.79 | ALDH1A1 (0.52) | ALDH1A1HPGDNPSR1MCOLN3TDP1 | |
| SCHEMBL9878549 | 0.77 | GAA (0.39) | ALDH1A1HPGDNPSR1MCOLN3PDE2A | |
| SCHEMBL9877920 | 0.76 | CYP19A1 (0.44) | ALDH1A1HPGDNPSR1MCOLN3PDE2A | |
| SCHEMBL9877649 | 0.76 | L3MBTL1 (0.35) | ALDH1A1HPGDCYP3A4ALOX15APEX1 | |
| SCHEMBL9879008 | 0.74 | CYP19A1 (0.42) | ALDH1A1HPGDNPSR1MCOLN3PDE2A | |
| SCHEMBL10785273 | 0.73 | KMT2A (0.54) | ALDH1A1KDM4EKMT2APOLBCA12 | |
| SCHEMBL27525369 | 0.72 | ALDH1A1 (0.53) | ALDH1A1HPGDALOX15L3MBTL1KDM4E | |
| SCHEMBL9877927 | 0.72 | KMT2A (0.54) | ALDH1A1KDM4ETSHRTDP1KMT2A | |
| SCHEMBL9878201 | 0.71 | KAT2B (0.46) | ALDH1A1TSHRTDP1KMT2ACYP19A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4992589-A | Substituted phenyl hydroxyethyl sulfones, and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-02-12 | — | — | US | disclosed |