Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | NOS1 | P29475 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | KDM6B | O15054 | 1/20 | 0.39 |
| ▸ | KDM4A | O75164 | 1/20 | 0.39 |
| ▸ | KDM4B | O94953 | 1/20 | 0.39 |
| ▸ | KDM5C | P41229 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10537469 | 0.85 | GABRA5 (0.44) | HSD17B10GABRA5GABRB2SMN1; SMN2NOS1 | |
| SCHEMBL2642609 | 0.82 | PIK3CG (0.53) | HSD17B10GABRA5GABRB2SMN1; SMN2NOS1 | |
| SCHEMBL2642900 | 0.78 | HTT (0.47) | HSD17B10GABRA5GABRB2SMN1; SMN2ALDH1A1 | |
| SCHEMBL16095753 | 0.78 | GSTO1 (0.47) | HSD17B10GABRA5GABRB2HTT | |
| SCHEMBL21695368 | 0.78 | GRM5 (0.45) | SMN1; SMN2ALDH1A1KDM4EHTTMAPT | |
| SCHEMBL4807003 | 0.76 | HSD17B10 (0.51) | HSD17B10GABRA5GABRB2SMN1; SMN2NOS1 | |
| SCHEMBL20558119 | 0.76 | CDK5 (0.45) | CCNA2CDK2CCNA1CDK5CDK5R1 | |
| SCHEMBL17675158 | 0.74 | CA1 (0.41) | SMN1; SMN2PIK3CGMEN1KMT2ACCNA2 | |
| SCHEMBL3138977 | 0.74 | RXFP1 (0.57) | SMN1; SMN2ALDH1A1KDM4EHTTMAPT | |
| SCHEMBL20557462 | 0.73 | CDK5 (0.43) | MEN1KMT2ACCNA2CDK2CCNA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101903378-B | Aminotriazole derivatives | ACTELION PHARMACEUTICALS LTD | 2014-03-12 | — | — | CN | disclosed |
| CN-101903378-A | Aminotriazole derivatives | ACTELION PHARMACEUTICALS LTD | 2010-12-01 | — | — | CN | disclosed |