Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 5/20 | 0.45 |
| ▸ | CA1 | P00915 | 5/20 | 0.45 |
| ▸ | CA2 | P00918 | 5/20 | 0.45 |
| ▸ | CA9 | Q16790 | 5/20 | 0.45 |
| ▸ | CKS1B | P61024 | 1/20 | 0.43 |
| ▸ | SKP1 | P63208 | 1/20 | 0.43 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | NQO2 | P16083 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SUCNR1 | Q9BXA5 | 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 | |
|---|---|---|---|---|
| SCHEMBL28672326 | 0.88 | CKS1B (0.47) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL19743714 | 0.84 | ALDH1A1 (0.46) | MAPTALDH1A1LMNAHTTNPSR1 | |
| SCHEMBL30131266 | 0.82 | CA12 (0.49) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL760341 | 0.81 | CA12 (0.48) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL30012375 | 0.81 | CA12 (0.48) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL16069038 | 0.81 | CA12 (0.48) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL28677773 | 0.81 | SCN9A (0.49) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL15756423 | 0.76 | CA12 (0.51) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL29420339 | 0.76 | CA12 (0.51) | CA12CA1CA2CA9CKS1B | |
| SCHEMBL16798103 | 0.75 | CKS1B (0.37) | CA12CA1CA2CA9CKS1B |
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-109563073-B | For the treatment of para-5-HT1AReceptor-controlled serotonergic disease-modulating compounds | 诺罗利西斯公司 | 2021-12-07 | — | — | CN | disclosed |