Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | GALR2 | O43603 | 1/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10510922 | 0.81 | PKM (0.49) | PKMLMNAALDH1A1ABCB1ABCC1 | |
| SCHEMBL9528380 | 0.78 | LMNA (0.44) | LMNAALDH1A1HTTKMT2APOLB | |
| SCHEMBL9687803 | 0.77 | PKM (0.47) | PKMLMNAALDH1A1HTTPOLB | |
| SCHEMBL10668450 | 0.76 | KMT2A (0.41) | PKMLMNAALDH1A1HTTKMT2A | |
| SCHEMBL9527341 | 0.74 | LMNA (0.48) | PKMLMNAALDH1A1HTTKMT2A | |
| SCHEMBL28878765 | 0.73 | GRIN2D (0.45) | PKMLMNAALDH1A1ABCB1ABCC1 | |
| SCHEMBL2902495 | 0.72 | ALDH1A1 (0.54) | PKMLMNAALDH1A1HTTKMT2A | |
| SCHEMBL7953766 | 0.72 | KMT2A (0.53) | PKMLMNAALDH1A1HTTEPHX1 | |
| SCHEMBL2848578 | 0.72 | ALDH1A1 (0.47) | PKMLMNAALDH1A1HTTEPHX1 | |
| SCHEMBL31423349 | 0.70 | ALDH1A1 (0.56) | PKMLMNAALDH1A1HTTEPHX1 |
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-0201575-B1 | NEW PICOLINE DERIVATIVES, PREPARATION PROCESS THEREOF, UTILIZATION THEREOF AND DRUGS CONTAINING THEM | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1992-08-12 | — | — | EP | disclosed |
| US-4686230-A | Picoline derivative useful as gastric acid secretion inhibitors | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1987-08-11 | — | — | US | disclosed |