Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 3/20 | 0.37 |
| ▸ | MGLL | Q99685 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20343040 | 1.00 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL23073548 | 0.98 | PTGS2 (0.42) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL10628918 | 0.85 | CYP2C19 (0.39) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL14544053 | 0.85 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL10118529 | 0.85 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL19328622 | 0.84 | NPY5R (0.38) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL19151931 | 0.84 | PTGS2 (0.52) | ALDH1A1PTGS2CHRNB2CHRNA4ACP3 | |
| SCHEMBL20099084 | 0.82 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL13010631 | 0.82 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 | |
| SCHEMBL13339008 | 0.82 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1CYP3A4KDM4ECYP1A2 |
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-3742510-A1 | ORGANIC LIGHT-EMITTING DEVICE | Samsung Display Co., Ltd. (KR) | 2020-11-25 | — | — | EP | disclosed |