Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.57 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.46 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12561165 | 0.85 | HDAC1 (0.52) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL29858336 | 0.84 | NPSR1 (0.64) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL19407338 | 0.84 | NPSR1 (0.64) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL15578063 | 0.82 | HDAC1 (0.61) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL933223 | 0.81 | HDAC1 (0.64) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL20353961 | 0.81 | HDAC1 (0.59) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL20353962 | 0.80 | CYP1A2 (0.61) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL31536348 | 0.80 | HDAC1 (0.56) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 | |
| SCHEMBL3533290 | 0.78 | CYP1A2 (0.62) | CYP1A2ALDH1A1HPGDCYSLTR1MEN1 | |
| SCHEMBL8843269 | 0.77 | CYP1A2 (0.50) | HDAC1HDAC2ADORA2ACYP1A2HDAC8 |
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-108467369-A | BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS | 诺华股份有限公司 | 2018-08-31 | — | — | CN | disclosed |
| CN-105143209-B | Biaryl amide compounds as kinase inhibitors | 诺华股份有限公司 | 2018-03-13 | — | — | CN | disclosed |