Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.45 |
| ▸ | BCR | P11274 | 1/20 | 0.45 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.45 |
| ▸ | PRKCA | P17252 | 1/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.43 |
| ▸ | TEK | Q02763 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | ITK | Q08881 | 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 | |
|---|---|---|---|---|
| SCHEMBL29172520 | 1.00 | CYP11B1 (0.46) | CYP11B1CYP11B2ABL1PDGFRBBCR | |
| SCHEMBL29172518 | 0.93 | BRAF (0.48) | ABL1PDGFRBBCRPDGFRAPRKCA | |
| SCHEMBL30725845 | 0.93 | BRAF (0.48) | ABL1PDGFRBBCRPDGFRAPRKCA | |
| SCHEMBL29172524 | 0.90 | PRKCA (0.43) | CYP11B1CYP11B2ABL1PDGFRBBCR | |
| SCHEMBL30725853 | 0.90 | CYP11B1 (0.47) | CYP11B1CYP11B2ABL1PDGFRBBCR | |
| SCHEMBL29172517 | 0.90 | CYP11B1 (0.47) | CYP11B1CYP11B2ABL1PDGFRBBCR | |
| SCHEMBL29172481 | 0.87 | NAMPT (0.43) | CYP11B1CYP11B2ABL1PDGFRBBCR | |
| SCHEMBL29172485 | 0.85 | BRAF (0.45) | CYP11B1CYP11B2ABL1BCRTEK | |
| SCHEMBL30725867 | 0.85 | BRAF (0.45) | CYP11B1CYP11B2ABL1BCRTEK | |
| SCHEMBL29172522 | 0.85 | L3MBTL1 (0.43) | LRRK2MAPTRXFP1GAAMAPK1 |
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-117186066-A | Indazole ALK5 inhibitor and preparation method and application thereof | 中国药科大学 | 2023-12-08 | — | — | CN | disclosed |