Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 5/20 | 0.67 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.55 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.55 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.55 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | P4HB | P07237 | 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 | |
|---|---|---|---|---|
| SCHEMBL197395 | 0.87 | NOTUM (0.62) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL15077181 | 0.85 | PDK1 (0.52) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL1997248 | 0.84 | NOTUM (0.73) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL665618 | 0.83 | CA12 (0.51) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL9859293 | 0.81 | MEN1 (0.47) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL3902096 | 0.81 | NOTUM (0.69) | NOTUMPDK2ALDH1A1MRGPRX4CA12 | |
| SCHEMBL3830811 | 0.81 | NOTUM (0.69) | NOTUMPDK2ALDH1A1MRGPRX4CA12 | |
| SCHEMBL3903076 | 0.81 | NOTUM (0.69) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL536555 | 0.81 | NOTUM (0.52) | NOTUMPDK2PDK1PDK3PDK4 | |
| SCHEMBL313146 | 0.81 | KIF11 (0.54) | NOTUMPDK1MRGPRX4RAB9ACYP1A2 |
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-119325476-A | Nitrogen-containing condensed 2, 3-dihydroquinazolinone compounds as NAV1.8 inhibitors | 葛兰素史密斯克莱知识产权发展有限公司 | 2025-01-17 | — | — | CN | disclosed |
| CN-106794161-A | TrkA kinase inhibitors, composition and its method | 默沙东公司 | 2017-05-31 | — | — | CN | disclosed |