Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.45 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | AXL | P30530 | 1/20 | 0.44 |
| ▸ | PRKCI | P41743 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.42 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | METAP2 | P50579 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | CSF1R | P07333 | 1/20 | 0.40 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | FLT3 | P36888 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28596888 | 1.00 | ADRA2A (0.47) | ADRA2ACCNT1CCNA2CDK2CDK9 | |
| SCHEMBL10125107 | 0.82 | ADRA2A (0.47) | ADRA2ACCNT1CCNA2CDK2CDK9 | |
| SCHEMBL414693 | 0.80 | CDK9 (0.54) | ADRA2ACCNT1CCNA2CDK2CDK9 | |
| SCHEMBL30173274 | 0.76 | JAK1 (0.55) | ADRA2APRKCQPRKCDMKNK1NPC1 | |
| SCHEMBL28597935 | 0.76 | JAK1 (0.55) | ADRA2APRKCQPRKCDMKNK1NPC1 | |
| SCHEMBL30173290 | 0.75 | PRKCI (0.51) | CDK9AXLPRKCIPRKCQCSF1R | |
| SCHEMBL28603791 | 0.75 | PRKCI (0.51) | CDK9AXLPRKCIPRKCQCSF1R | |
| SCHEMBL30173305 | 0.73 | JAK2 (0.58) | CDK2CDK9AXLPRKCIPRKCQ | |
| SCHEMBL3725709 | 0.73 | JAK2 (0.58) | CDK2CDK9AXLPRKCIPRKCQ | |
| SCHEMBL13201329 | 0.73 | CDK8 (0.59) | ADRA2ACCNT1CCNA2CDK2CDK9 |
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-113200983-B | Compound with pyrrolopyridine structure, preparation method and medical application | 中国药科大学 | 2023-01-03 | — | — | CN | disclosed |