Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.43 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.41 |
| ▸ | GABBR2 | O75899 | 4/20 | 0.41 |
| ▸ | GABBR1 | Q9UBS5 | 4/20 | 0.41 |
| ▸ | CPA1 | P15085 | 2/20 | 0.41 |
| ▸ | CPB1 | P15086 | 1/20 | 0.41 |
| ▸ | CPA3 | P15088 | 1/20 | 0.41 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL27565946 | 0.91 | TDP1 (0.45) | POLBSMN1; SMN2TDP1SOAT1CPA1 | |
| SCHEMBL4168904 | 0.85 | CPA1 (0.56) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL6898209 | 0.80 | LOXL2 (0.52) | TDP1SOAT1LOXL2CYP3A4MEN1 | |
| SCHEMBL762549 | 0.79 | LOXL2 (0.50) | SMN1; SMN2TDP1LOXL2NPC1RAB9A | |
| SCHEMBL288929 | 0.78 | ANPEP (0.51) | POLBSMN1; SMN2TDP1SOAT1CPA1 | |
| SCHEMBL27999577 | 0.78 | ANPEP (0.51) | POLBSMN1; SMN2TDP1SOAT1CPA1 | |
| SCHEMBL763169 | 0.78 | CACNA2D1 (0.37) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL5491720 | 0.77 | CACNA2D1 (0.36) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL11586603 | 0.76 | CPA1 (0.70) | CPA1CPB1CPA3CPB2CYP1A2 | |
| SCHEMBL15134800 | 0.76 | NPC1 (0.46) | POLBSMN1; SMN2TDP1SOAT1CPA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |