Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.55 |
| ▸ | CCR5 | P51681 | 2/20 | 0.55 |
| ▸ | CCR8 | P51685 | 2/20 | 0.55 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.41 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.41 |
| ▸ | SLC40A1 | Q9NP59 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Quinmerac SCHEMBL54128 | 0.88 | ALK (0.60) | CCR1CCR5CCR8ALKPARP1 | |
| Quinmerac SCHEMBL29351452 | 0.88 | ALK (0.60) | CCR1CCR5CCR8ALKPARP1 | |
| Quinmerac SCHEMBL8539662 | 0.88 | ALK (0.60) | CCR1CCR5CCR8ALKPARP1 | |
| Quinmerac SCHEMBL29433226 | 0.88 | ALK (0.60) | CCR1CCR5CCR8ALKPARP1 | |
| SCHEMBL10533475 | 0.86 | PARP1 (0.56) | CCR1CCR5CCR8ALKPARP1 | |
| Quinmerac SCHEMBL28113431 | 0.86 | ALK (0.59) | CCR1CCR5CCR8ALKPARP1 | |
| SCHEMBL29519705 | 0.84 | ALK (0.49) | CCR1CCR5CCR8ALKALDH1A1 | |
| SCHEMBL8612242 | 0.84 | ALK (0.49) | CCR1CCR5CCR8ALKALDH1A1 | |
| SCHEMBL10531532 | 0.84 | CCR1 (0.50) | CCR1CCR5CCR8ALKPARP1 | |
| SCHEMBL10531732 | 0.84 | CCR1 (0.50) | CCR1CCR5CCR8ALKPARP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110903279-B | Pyrazole compound, salt and application thereof | 潍坊中农联合化工有限公司 | 2023-05-16 | — | — | CN | disclosed |
| CN-110615781-B | Pyrazole derivative and preparation method and application thereof | 山东省联合农药工业有限公司 | 2020-09-08 | — | — | CN | disclosed |
| CN-110903279-A | Pyrazole compound and salt and application thereof | 潍坊中农联合化工有限公司 | 2020-03-24 | — | — | CN | disclosed |
| CN-110615781-A | Pyrazole derivative and preparation method and application thereof | 山东省联合农药工业有限公司 | 2019-12-27 | — | — | CN | disclosed |