Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.42 |
| ▸ | ESR1 | P03372 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | CASP9 | P55211 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11152376 | 0.85 | NPSR1 (0.44) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL11150319 | 0.82 | ESR1 (0.43) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL11157669 | 0.80 | ALDH1A1 (0.52) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL11141660 | 0.77 | HPGD (0.52) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL11148393 | 0.77 | ALDH1A1 (0.49) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL11160643 | 0.75 | ALDH1A1 (0.41) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL4775229 | 0.73 | ALDH1A1 (0.57) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL10818963 | 0.73 | ALDH1A1 (0.56) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL11154785 | 0.73 | ALDH1A1 (0.39) | ALDH1A1KMT2ANPSR1KDM4EMEN1 | |
| SCHEMBL2007090 | 0.71 | ALDH1A1 (0.56) | ALDH1A1KMT2ANPSR1KDM4EMEN1 |
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-4389416-A | DIURETICS | ABBOTT LABORATORIES (US) | 1983-06-21 | — | — | US | disclosed |