Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.37 |
| ▸ | CDK1 | P06493 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.36 |
| ▸ | CDK2 | P24941 | 2/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | FDPS | P14324 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5999472 | 0.81 | KCNH3 (0.39) | KCNH3CDK5CDK1CDK2AURKA | |
| SCHEMBL9272660 | 0.80 | ALDH1A1 (0.48) | ALDH1A1MEN1NPC1RAB9AKMT2A | |
| SCHEMBL24103625 | 0.79 | APLNR (0.39) | KCNH3CDK5CDK1MAPK1CDK2 | |
| SCHEMBL29751802 | 0.79 | APLNR (0.39) | KCNH3CDK5CDK1MAPK1CDK2 | |
| SCHEMBL9602995 | 0.78 | ALDH1A1 (0.39) | ALDH1A1LMNAHTTMAPK1MEN1 | |
| SCHEMBL2790314 | 0.78 | P2RX3 (0.41) | KCNH3CDK5CDK1MAPK1CDK2 | |
| SCHEMBL7899242 | 0.78 | P2RX3 (0.41) | KCNH3CDK5CDK1MAPK1CDK2 | |
| SCHEMBL29751819 | 0.78 | MAPK1 (0.40) | KCNH3CDK1MAPK1CDK2 | |
| SCHEMBL2789226 | 0.78 | P2RX3 (0.41) | KCNH3CDK5CDK1MAPK1CDK2 | |
| SCHEMBL24567768 | 0.77 | TLR8 (0.48) | ALDH1A1NPC1CYP2C19IDH1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0232623-B1 | 1-CARBACEPHALOSPORIN ANTIBIOTICS | ELI LILLY AND COMPANY (US) | 1993-03-17 | — | — | EP | disclosed |
| US-4892942-A | 1-CARBA (DETHIA)CEPHALOSPORINS | ELI LILLY AND COMPANY (US) | 1990-01-09 | — | — | US | disclosed |
| US-4791106-A | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1988-12-13 | — | — | US | disclosed |
| EP-0232623-A1 | 1-Carbacephalosporin antibiotics | ELI LILLY AND COMPANY (US) | 1987-08-19 | — | — | EP | disclosed |