Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | GRM8 | O00222 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5929629 | 1.00 | LMNA (0.42) | LMNAHTTSMN1; SMN2NAPRTGAA | |
| SCHEMBL7056950 | 0.83 | LMNA (0.52) | LMNAGAAKDM4EMAPTMAPK1 | |
| SCHEMBL687445 | 0.83 | LMNA (0.52) | LMNAGAAKDM4EMAPTMAPK1 | |
| SCHEMBL295743 | 0.83 | LMNA (0.52) | LMNAGAAKDM4EMAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL6725570 | 0.81 | NAPRT (0.44) | LMNAHTTSMN1; SMN2NAPRTGAA | |
| SCHEMBL5929551 | 0.80 | SMN1; SMN2 (0.50) | LMNASMN1; SMN2GAAGRM8GRM4 | |
| SCHEMBL5160712 | 0.80 | SMN1; SMN2 (0.50) | LMNASMN1; SMN2GAAGRM8GRM4 | |
| SCHEMBL28608274 | 0.78 | CES2 (0.46) | GRM8GRM4AKR1C3AKR1C2 | |
| SCHEMBL10644619 | 0.76 | AKR1C3 (0.51) | GRM8GRM4AKR1C3AKR1C2 | |
| SCHEMBL3176050 | 0.76 | KDM4E (0.44) | LMNANAPRTGAAGRM8GRM4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1340746-B1 | Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives | SALTIGO GMBH (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1340746-A1 | Process for the reduction of 3-heteroaryl-3-oxo-propanoic acid derivatives | BAYER AG (DE) | 2003-09-03 | — | — | EP | disclosed |