Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL2516651 | 0.71 | POLB (0.44) | CA12CA9SCN2ACA1CA2 | |
| SCHEMBL2479901 | 0.69 | ALDH1A1 (0.44) | CA12CA9SCN2ACA1CA2 | |
| SCHEMBL8110895 | 0.67 | LMNA (0.55) | ALDH1A1HPGDHTT | |
| SCHEMBL12202124 | 0.67 | BCAT2 (0.41) | CA12CA9SCN2ACA1CA2 | |
| SCHEMBL7265004 | 0.65 | MEN1 (0.41) | CA12CA9SCN2ACA1CA2 | |
| SCHEMBL31663432 | 0.65 | CA9 (1.00) | CA12CA9SCN2ACA1CA2 | |
| N-Phthaloylanthranilic Acid SCHEMBL29549628 | 0.65 | APEX1 (0.71) | CA12CA9SCN2ACA1CA2 | |
| N-Phthaloylanthranilic Acid SCHEMBL481284 | 0.65 | APEX1 (0.71) | CA12CA9SCN2ACA1CA2 | |
| SCHEMBL481667 | 0.65 | CA9 (1.00) | CA12CA9SCN2ACA1CA2 | |
| SCHEMBL11611884 | 0.64 | ALDH1A1 (0.67) | CA12CA9SCN2ACA1CA2 |
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-118908957-A | Small molecule inhibitors of NF- κB induced kinase | 詹森药业有限公司 | 2024-11-08 | — | — | CN | disclosed |
| CN-114222737-B | Small molecule inhibitors of NF- κB induced kinase | 詹森药业有限公司 | 2024-07-26 | — | — | CN | disclosed |