Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | DCTPP1 | Q9H773 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | GPR174 | Q9BXC1 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17057943 | 0.83 | ALDH1A1 (0.36) | ALDH1A1MAPTSMN1; SMN2DCTPP1KDM4E | |
| SCHEMBL14081413 | 0.83 | TP53 (0.44) | MAPTSMN1; SMN2DCTPP1LMNAPOLB | |
| SCHEMBL17058327 | 0.81 | POLB (0.41) | ALDH1A1MAPTNPY5RSMN1; SMN2DCTPP1 | |
| SCHEMBL17058155 | 0.81 | POLB (0.35) | ALDH1A1MAPTSMN1; SMN2DCTPP1KDM4E | |
| SCHEMBL17057996 | 0.79 | POLB (0.36) | ALDH1A1MAPTSMN1; SMN2DCTPP1KDM4E | |
| SCHEMBL17058109 | 0.73 | ALDH1A1 (0.33) | ALDH1A1NPY5RSMN1; SMN2DCTPP1KDM4E | |
| SCHEMBL11943859 | 0.73 | ROCK2 (0.39) | ALDH1A1SMN1; SMN2DCTPP1KDM4EPKM | |
| SCHEMBL11943861 | 0.72 | ALDH1A1 (0.37) | ALDH1A1SMN1; SMN2DCTPP1KDM4EPKM | |
| SCHEMBL11946121 | 0.69 | ALDH1A1 (0.51) | ALDH1A1MAPTSMN1; SMN2DCTPP1KDM4E | |
| SCHEMBL17058437 | 0.69 | ALDH1A1 (0.40) | ALDH1A1MAPTNPY5RSMN1; SMN2DCTPP1 |
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-2137179-B1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-09-02 | — | — | EP | disclosed |