Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 17/20 | 0.61 |
| ▸ | PRKCA | P17252 | 10/20 | 0.61 |
| ▸ | PRKCD | Q05655 | 7/20 | 0.61 |
| ▸ | EGFR | P00533 | 3/20 | 0.61 |
| ▸ | BCR | P11274 | 16/20 | 0.60 |
| ▸ | SRC | P12931 | 9/20 | 0.60 |
| ▸ | PRKACA | P17612 | 1/20 | 0.60 |
| ▸ | PRKACG | P22612 | 1/20 | 0.60 |
| ▸ | PRKACB | P22694 | 1/20 | 0.60 |
| ▸ | PDGFRB | P09619 | 6/20 | 0.55 |
| ▸ | PDGFRA | P16234 | 6/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.54 |
| ▸ | PRKCG | P05129 | 2/20 | 0.54 |
| ▸ | PRKCB | P05771 | 2/20 | 0.54 |
| ▸ | PRKCH | P24723 | 2/20 | 0.54 |
| ▸ | PRKCI | P41743 | 2/20 | 0.54 |
| ▸ | PRKCE | Q02156 | 2/20 | 0.54 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.54 |
| ▸ | PRKCZ | Q05513 | 2/20 | 0.54 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28957446 | 0.83 | ABL1 (0.61) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL28371930 | 0.79 | NR4A1 (0.67) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL29618427 | 0.78 | ABL1 (0.85) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL30175794 | 0.78 | ABL1 (0.73) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL6262145 | 0.76 | ABL1 (1.00) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL7476133 | 0.76 | ABL1 (0.76) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL7461475 | 0.76 | ABL1 (0.76) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL3868291 | 0.76 | ABL1 (0.76) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL16932355 | 0.76 | ABL1 (0.76) | ABL1PRKCAPRKCDEGFRBCR | |
| SCHEMBL7464205 | 0.76 | ABL1 (0.76) | ABL1PRKCAPRKCDEGFRBCR |
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-107739368-B | N-substituted-5- ((4-substituted pyrimidine-2-yl) amino) indole derivatives, and preparation method and application thereof | 厦门大学 | 2020-02-14 | — | — | CN | disclosed |