Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | AXL | P30530 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.30 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3982745 | 0.73 | ALDH1A1 (0.47) | ALDH1A1MAPK1SIGMAR1CFTRGOPC | |
| SCHEMBL19834905 | 0.71 | ALDH1A1 (0.35) | ALDH1A1SIGMAR1CFTRGOPCHTR2C | |
| SCHEMBL28664458 | 0.70 | ALDH1A1 (0.33) | ALDH1A1MAPK1SIGMAR1CFTRGOPC | |
| SCHEMBL24169825 | 0.68 | ALDH1A1 (0.39) | ALDH1A1MAPK1SIGMAR1HTR2CTDP1 | |
| SCHEMBL7821424 | 0.68 | ALDH1A1 (0.32) | ALDH1A1SIGMAR1CFTRGOPCHTR2C | |
| SCHEMBL28199530 | 0.68 | CFTR (0.40) | ALDH1A1SIGMAR1CFTRGOPCAXL | |
| SCHEMBL7823616 | 0.68 | ALDH1A1 (0.32) | ALDH1A1SIGMAR1CFTRGOPCHTR2C | |
| SCHEMBL457003 | 0.67 | ALDH1A1 (0.33) | ALDH1A1MAPK1SIGMAR1CFTRGOPC | |
| SCHEMBL457777 | 0.67 | ALDH1A1 (0.33) | ALDH1A1MAPK1SIGMAR1CFTRGOPC | |
| SCHEMBL526305 | 0.65 | ALDH1A1 (0.38) | ALDH1A1SIGMAR1CFTRGOPCHTR2C |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3107977-B1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2018-01-24 | — | — | EP | disclosed |