Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 2/20 | 0.40 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | MCHR2 | Q969V1 | 1/20 | 0.40 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL24065505 | 1.00 | RAF1 (0.42) | RAF1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL30965478 | 0.84 | MAPT (0.52) | RAF1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL24065475 | 0.84 | MAPT (0.52) | RAF1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL30965496 | 0.82 | CYP19A1 (0.61) | RAF1NPC1IMPDH2CYP19A1 | |
| SCHEMBL23292615 | 0.82 | CYP19A1 (0.61) | RAF1NPC1IMPDH2CYP19A1 | |
| SCHEMBL23292626 | 0.78 | NPC1 (0.51) | RAF1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL21305508 | 0.78 | NPC1 (0.54) | RAF1SMN1; SMN2CA12CA1CA2 | |
| SCHEMBL24065504 | 0.77 | KDM4E (0.47) | SMN1; SMN2KDM4EALDH1A1NPC1MAPT | |
| SCHEMBL30965508 | 0.77 | KDM4E (0.47) | SMN1; SMN2KDM4EALDH1A1NPC1MAPT | |
| SCHEMBL23292656 | 0.77 | NPC1 (0.50) | SMN1; SMN2CA12CA1CA2CA9 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112513032-B | 4-Substituted phenyl-1, 3, 5-triazine derivatives as modulators of TRK receptors | 阿泽克制药公司 | 2024-07-02 | — | — | CN | disclosed |