Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25364962 | 0.77 | CA1 (0.35) | ALDH1A1CA1CA2CA4CA5A | |
| SCHEMBL17240202 | 0.77 | POLB (0.50) | ALDH1A1CA1CA2CA4CA5A | |
| SCHEMBL4945390 | 0.67 | CA1 (0.47) | ALDH1A1CA1CA2CA4CA5A | |
| SCHEMBL3599000 | 0.67 | CA1 (0.47) | CA1CA2CA4CA5ACA5B | |
| SCHEMBL10770478 | 0.64 | APEX1 (0.33) | ALDH1A1CA1CA2CA4CA5A | |
| SCHEMBL10403237 | 0.64 | F2 (0.39) | ALDH1A1 | |
| SCHEMBL2377189 | 0.62 | CA1 (0.37) | CA1CA2CA4CA5ACA5B | |
| SCHEMBL12179231 | 0.61 | NOS1 (0.43) | ALDH1A1 | |
| SCHEMBL12179409 | 0.60 | LOXL2 (0.34) | CA1CA2 | |
| SCHEMBL2376213 | 0.58 | CYP1A2 (0.47) | ALDH1A1 |
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-4914206-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-04-03 | — | — | US | disclosed |
| EP-0226896-A2 | Lankacidin derivatives and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1987-07-01 | — | — | EP | disclosed |