Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 4/20 | 0.56 |
| ▸ | CA12 | O43570 | 6/20 | 0.54 |
| ▸ | CA1 | P00915 | 6/20 | 0.54 |
| ▸ | CA2 | P00918 | 6/20 | 0.54 |
| ▸ | CA9 | Q16790 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | KCNJ6 | P48051 | 1/20 | 0.51 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.51 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.51 |
| ▸ | P2RX4 | Q99571 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | RAF1 | P04049 | 2/20 | 0.47 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.46 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.46 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28738385 | 1.00 | IDH1 (0.56) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL28738420 | 0.92 | IDH1 (0.56) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL29625922 | 0.92 | IDH1 (0.56) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL21295431 | 0.81 | STK39 (0.58) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL21295536 | 0.80 | KDR (0.61) | MAPTRAB9ATP53TSHRRAF1 | |
| SCHEMBL21305508 | 0.78 | NPC1 (0.54) | CA12CA1CA2CA9MAPT | |
| SCHEMBL21295345 | 0.78 | STK39 (0.58) | CA12CA1CA2CA9MAPT | |
| SCHEMBL31054233 | 0.78 | MEN1 (0.62) | IDH1CA12CA1CA2CA9 | |
| SCHEMBL21295379 | 0.78 | PNLIP (0.66) | MAPTNPC1RAB9A | |
| SCHEMBL21305446 | 0.77 | STK39 (0.60) | IDH1CA12CA1CA2CA9 |
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-114423743-A | Triazine derivatives for the treatment of diseases associated with neurotrophic factors | 阿泽克制药公司 | 2022-04-29 | — | — | CN | disclosed |