Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 2/20 | 0.38 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | NOX4 | Q9NPH5 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9714037 | 0.88 | PKM (0.46) | CDK1CA2PKMCYP2C19GAA | |
| SCHEMBL9713905 | 0.88 | PKM (0.46) | CA2PKMCYP2C19GAAALDH1A1 | |
| SCHEMBL9713778 | 0.87 | CDK1 (0.68) | CDK1CA2PKMCYP2C19GAA | |
| SCHEMBL9714080 | 0.84 | GAA (0.51) | CDK1CA2PKMCYP2C19GAA | |
| SCHEMBL9713906 | 0.79 | L3MBTL1 (0.43) | CA2PKMCYP2C19GAAALDH1A1 | |
| SCHEMBL9713813 | 0.79 | CDK1 (0.67) | CDK1CA2PKMCYP2C19GAA | |
| SCHEMBL9713943 | 0.79 | CYP2C19 (0.43) | CA2PKMCYP2C19GAAALDH1A1 | |
| SCHEMBL9713763 | 0.78 | HSD11B1 (0.48) | CA2PKMCYP2C19GAAALDH1A1 | |
| SCHEMBL23717441 | 0.76 | ALDH1A1 (0.59) | CDK1GAAALDH1A1KDM4EHPGD | |
| SCHEMBL9713825 | 0.75 | ABCC9 (0.45) | PKMCYP2C19GAAALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5084449-A | Bactericides and antiprotozoa agents | DR. KARL THOMAE GMBH (DE) | 1992-01-28 | — | — | US | disclosed |
| US-4992430-A | Anti-bacterial compositions comprising a substituted bis-(4-aminophenyl)-sulfone and a dihydro-folic acid reductase | DR. KARL THOMAE GMBH (DE) | 1991-02-12 | — | — | US | disclosed |
| US-4829058-A | INHIBITORS OF BACTERIA, MYCOBACTERIA AND PLASMODIA | DR. KARL THOMAE GMBH (DE) | 1989-05-09 | — | — | US | disclosed |