Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12925376 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL5031076 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL4570413 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL12925467 | 1.00 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL12925365 | 0.98 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL12925413 | 0.98 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL12603683 | 0.98 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL12925363 | 0.98 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL12925535 | 0.98 | ALDH1A1 (0.43) | ALDH1A1TSHRTDP1TP53PTGS2 | |
| SCHEMBL5196214 | 0.96 | TDP1 (0.44) | ALDH1A1TSHRTDP1TP53PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-20070009760-A1 | Coordination metal compound, material for organic electroluminescence device, material for luminescent coating formation and organic electroluminescence device | INOUE TETSUYA | 2007-01-11 | — | — | US | disclosed |