Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GPR139 | Q6DWJ6 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 6/20 | 0.38 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.38 |
| ▸ | PRKG1 | Q13976 | 3/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.38 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.38 |
| ▸ | PRKCG | P05129 | 2/20 | 0.38 |
| ▸ | CDK1 | P06493 | 2/20 | 0.38 |
| ▸ | PRKACA | P17612 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29006260 | 0.86 | CNR1 (0.39) | ALDH1A1LMNAHTTSMN1; SMN2NPSR1 | |
| SCHEMBL29006279 | 0.86 | ALDH1A1 (0.43) | TDP1ALDH1A1GPR139MTNR1AMTNR1B | |
| SCHEMBL29006257 | 0.85 | HDAC4 (0.46) | MEN1POLBKMT2ANPSR1RPS6KB1 | |
| SCHEMBL29006259 | 0.84 | NPSR1 (0.44) | ALDH1A1MEN1LMNAPOLBKMT2A | |
| SCHEMBL29006265 | 0.79 | HTT (0.38) | TDP1ALDH1A1MEN1POLBHTT | |
| SCHEMBL29006282 | 0.78 | HDAC3 (0.41) | TDP1LMNAPOLBSMN1; SMN2MAPK1 | |
| SCHEMBL29006256 | 0.77 | OXTR (0.41) | MEN1KMT2ANPSR1CYP3A4 | |
| SCHEMBL17865258 | 0.75 | PKM (0.54) | MTNR1AMTNR1B | |
| SCHEMBL29006270 | 0.74 | CNR2 (0.39) | LMNAPOLBNPSR1MAPK1 | |
| SCHEMBL29006280 | 0.74 | HDAC4 (0.41) | MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116003323-B | Fluorine-containing pyrazole phenylacetamide derivative and application thereof | 西北农林科技大学 | 2023-12-08 | — | — | CN | disclosed |
| CN-116003323-A | Fluorine-containing pyrazole phenylacetamide derivative and application thereof | 西北农林科技大学 | 2023-04-25 | — | — | CN | disclosed |