Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | PTAFR | P25105 | 5/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.50 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8889603 | 0.89 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1USP2NPSR1PTAFR | |
| SCHEMBL8890208 | 0.85 | PDE4A (0.59) | SMPD1 | |
| SCHEMBL8889763 | 0.84 | PDE4A (0.61) | ALDH1A1L3MBTL1USP2NPSR1PTAFR | |
| SCHEMBL23317129 | 0.83 | ALDH1A1 (0.59) | ALDH1A1L3MBTL1USP2NPSR1SMPD1 | |
| SCHEMBL8889710 | 0.83 | PDE4D (0.67) | ALDH1A1L3MBTL1USP2NPSR1PTAFR | |
| SCHEMBL8889931 | 0.83 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1USP2NPSR1PTAFR | |
| SCHEMBL8889809 | 0.82 | PDE4B (0.70) | ALDH1A1L3MBTL1USP2NPSR1PTAFR | |
| SCHEMBL1560215 | 0.81 | LPAR1 (0.60) | SMPD1POLB | |
| SCHEMBL8890887 | 0.79 | FDPS (0.55) | ALDH1A1L3MBTL1USP2NPSR1PTAFR | |
| SCHEMBL8891275 | 0.79 | F10 (0.52) | ALDH1A1NPSR1CYP1A2KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997003967-A1 | SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE | RHONE-POULENC RORER LIMITED (GB) | 1997-02-06 | — | — | WO | disclosed |