Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | NPC1 | O15118 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11881871 | 0.82 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2CYP1A2CYP2C19NPC1 | |
| SCHEMBL10919575 | 0.82 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2CYP1A2CYP2C19NPC1 | |
| SCHEMBL13831514 | 0.77 | SMN1; SMN2 (1.00) | ALDH1A1SMN1; SMN2CYP1A2CYP2C19NPC1 | |
| SCHEMBL25837699 | 0.77 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2CYP1A2CYP2C19NPC1 | |
| SCHEMBL80194 | 0.76 | USP5 (0.68) | ALDH1A1SMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL311956 | 0.76 | USP5 (0.68) | ALDH1A1SMN1; SMN2NPC1RAB9ALMNA | |
| SCHEMBL2988877 | 0.75 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2CYP1A2CYP2C19NPC1 | |
| SCHEMBL12247551 | 0.72 | ALDH1A1 (0.78) | ALDH1A1SMN1; SMN2CYP1A2CYP2C19NPC1 | |
| SCHEMBL6962063 | 0.72 | KDM4E (0.47) | ALDH1A1SMN1; SMN2CYP2C19MAPTKMT2A | |
| SCHEMBL18787411 | 0.71 | KMT2A (0.67) | ALDH1A1SMN1; SMN2NPC1RAB9ALMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2619179-A1 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2013-07-31 | — | — | EP | claimed |
| EP-2619185-A1 | MATRIX METALLOPROTEINASE INHIBITORS | Ranbaxy Laboratories Limited (IN) | 2013-07-31 | — | — | EP | claimed |
| WO-2012038944-A1 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-03-29 | — | — | WO | claimed |
| WO-2012038942-A1 | MATRIX METALLOPROTEINASE INHIBITORS | RANBAXY LABORATORIES LIMITED (IN) | 2012-03-29 | — | — | WO | claimed |