Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.40 |
| ▸ | CES1 | P23141 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27333323 | 0.82 | NPSR1 (0.43) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL27483458 | 0.77 | NPSR1 (0.39) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL27467328 | 0.76 | ALDH1A1 (0.54) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL28864795 | 0.76 | NPSR1 (0.37) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL27978783 | 0.72 | TDP1 (0.40) | NPSR1ALDH1A1KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL27619813 | 0.70 | NPSR1 (0.44) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL455438 | 0.70 | KMT2A (0.53) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL891832 | 0.69 | NPSR1 (0.55) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL19778 | 0.69 | NPSR1 (0.70) | NPSR1ALDH1A1GLATSHRRAB9A | |
| SCHEMBL13736332 | 0.69 | HTT (0.46) | NPSR1ALDH1A1GLATSHRCES1 |
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-104011142-B | There is the compound of ton skeleton, coloured composition, ink for ink-jet recording and ink jet recording method | 富士胶片株式会社 | 2016-11-16 | — | — | CN | disclosed |