Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9052834 | 0.74 | CYP19A1 (0.33) | — | |
| SCHEMBL18547473 | 0.74 | SMN1; SMN2 (0.36) | SMN1; SMN2 | |
| SCHEMBL5677016 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL10922421 | 0.73 | SMN1; SMN2 (0.36) | SMN1; SMN2 | |
| SCHEMBL645146 | 0.73 | CYP19A1 (0.36) | — | |
| SCHEMBL6623048 | 0.72 | CYP2C19 (0.40) | — | |
| SCHEMBL383268 | 0.71 | CYP2C19 (0.32) | — | |
| SCHEMBL30683839 | 0.71 | NPSR1 (0.34) | CTSKUSP2SMN1; SMN2 | |
| SCHEMBL30859305 | 0.70 | CTSK (0.30) | CTSKUSP2SMN1; SMN2 | |
| SCHEMBL4743034 | 0.70 | CYP4F2 (0.32) | CTSKUSP2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5409919-A | Pharmaceutically acceptable salt of 7B-[2-(5-amino-1,2,4-thio-diazol-3-yl)-2(Z)-metho-xyiminoacetamido]-3-[(imidazo[1,2-b]pyridazinium-1-yl)methyl]-3-cephem-4-carboxylate and composition comprising same | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1995-04-25 | — | — | US | disclosed |
| US-4962100-A | 3-Condensed imidazolium-cephem compounds | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-10-09 | — | — | US | disclosed |