Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28793388 | 0.83 | GAA (0.47) | SIGMAR1L3MBTL1ALDH1A1KDM4EGAA | |
| SCHEMBL6743206 | 0.79 | SIGMAR1 (0.51) | SIGMAR1L3MBTL1ALDH1A1KDM4EGAA | |
| SCHEMBL27559476 | 0.76 | SIGMAR1 (0.65) | SIGMAR1L3MBTL1ALDH1A1KMT2A | |
| SCHEMBL27938805 | 0.74 | ALDH1A1 (0.42) | SIGMAR1L3MBTL1ALDH1A1KDM4EGAA | |
| SCHEMBL28807637 | 0.74 | SIGMAR1 (0.43) | SIGMAR1L3MBTL1ALDH1A1KDM4EGAA | |
| SCHEMBL4949707 | 0.72 | SIGMAR1 (0.62) | SIGMAR1L3MBTL1ALDH1A1KDM4EKMT2A | |
| SCHEMBL29469736 | 0.72 | SIGMAR1 (0.62) | SIGMAR1L3MBTL1ALDH1A1KDM4EKMT2A | |
| SCHEMBL29234421 | 0.71 | GAA (0.58) | SIGMAR1L3MBTL1ALDH1A1KDM4EGAA | |
| Potassium Ion SCHEMBL16628603 | 0.70 | SIGMAR1 (0.47) | SIGMAR1L3MBTL1ALDH1A1KDM4EKMT2A | |
| SCHEMBL16628473 | 0.70 | SIGMAR1 (0.47) | SIGMAR1L3MBTL1ALDH1A1KDM4EKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105131004-B | Rhodamine B derivative, preparation method and the application of 1 naphthalenylisothiocyanate modification | 华南师范大学 | 2017-08-08 | — | — | CN | disclosed |