Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP1LC3B | Q9GZQ8 | 2/20 | 0.35 |
| ▸ | SMARCA4 | P51532 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9385567 | 0.72 | SMARCA4 (0.34) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL9385565 | 0.72 | SMARCA4 (0.34) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL8092347 | 0.72 | HTT (0.41) | ALDH1A1MAPTHTTSMN1; SMN2CYP2B6 | |
| SCHEMBL4399005 | 0.69 | SMARCA4 (0.40) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL4399007 | 0.69 | SMARCA4 (0.40) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL31230458 | 0.67 | ALDH1A1 (0.45) | ALDH1A1MAPTHTTSMN1; SMN2CYP2B6 | |
| SCHEMBL1528434 | 0.67 | KDM4E (0.39) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL3479747 | 0.67 | KDM4E (0.39) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL1528435 | 0.67 | KDM4E (0.39) | MAP1LC3BSMARCA4ALDH1A1MAPTHTT | |
| SCHEMBL7921220 | 0.65 | ITGB1 (0.37) | ALDH1A1MAPTHTTCYP2B6MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1554256-A4 | PIPERIDINO PYRIMIDINE DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OF DIABETES | MERCK & CO INC (US) | 2007-06-13 | — | — | EP | disclosed |
| EP-1554256-A1 | PIPERIDINO PYRIMIDINE DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OF DIABETES | Merck & Co., Inc. (US) | 2005-07-20 | — | — | EP | disclosed |
| WO-2004007468-A1 | PIPERIDINO PYRIMIDINE DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OF DIABETES | MERCK & CO., INC. (US) | 2004-01-22 | — | — | WO | disclosed |