Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.46 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | METAP2 | P50579 | 1/20 | 0.40 |
| ▸ | METAP1 | P53582 | 1/20 | 0.40 |
| ▸ | LTA4H | P09960 | 1/20 | 0.40 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6664357 | 0.96 | CTSS (0.44) | BCL2L1MCL1CTSLCTSSCTSK | |
| SCHEMBL6668702 | 0.88 | BCL2L1 (0.46) | BCL2L1MCL1CTSLCTSSALDH1A1 | |
| SCHEMBL6669920 | 0.87 | BCL2L1 (0.47) | BCL2L1MCL1CTSSALDH1A1KMO | |
| SCHEMBL3104440 | 0.83 | ALDH1A1 (0.50) | BCL2L1MCL1CTSSALDH1A1L3MBTL1 | |
| SCHEMBL6671105 | 0.82 | KMO (0.54) | BCL2L1MCL1ALDH1A1KMOPTPN1 | |
| SCHEMBL6674722 | 0.79 | KMO (0.57) | BCL2L1MCL1ALDH1A1KMOL3MBTL1 | |
| SCHEMBL16284887 | 0.79 | NPC1 (0.60) | KMOL3MBTL1 | |
| SCHEMBL16284888 | 0.79 | NPC1 (0.60) | KMOL3MBTL1 | |
| SCHEMBL6672877 | 0.79 | NPC1 (0.60) | KMOL3MBTL1 | |
| SCHEMBL3101828 | 0.79 | NPC1 (0.60) | KMOL3MBTL1 |
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-1448181-A1 | PHARMACEUTICAL COMPOSITION COMPRISING A COMBINATION OF METFORMIN AND A 4-OXOBUTANOIC ACID, AND THE USE THEREOF FOR TREATING DIABETES | MERCK PATENT GmbH (DE) | 2004-08-25 | — | — | EP | claimed |
| WO-2003045368-A1 | PHARMACEUTICAL COMPOSITION COMPRISING A COMBINATION OF METFORMIN AND A 4-OXOBUTANOIC ACID, AND THE USE THEREOF FOR TREATING DIABETES | MERCK PATENT GMBH (DE) | 2003-06-05 | — | — | WO | claimed |