Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.31 |
| ▸ | METAP2 | P50579 | 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 | |
|---|---|---|---|---|
| SCHEMBL19479801 | 0.77 | POLB (0.33) | CA2 | |
| SCHEMBL19479799 | 0.77 | POLB (0.33) | CA2 | |
| SCHEMBL988652 | 0.77 | POLB (0.33) | CA2 | |
| SCHEMBL20402011 | 0.75 | CA2 (0.32) | CA2 | |
| SCHEMBL9225694 | 0.71 | POLB (0.30) | CA2 | |
| SCHEMBL18408761 | 0.69 | POLB (0.39) | — | |
| SCHEMBL16385802 | 0.69 | CA2 (0.32) | CA2 | |
| SCHEMBL20401706 | 0.69 | CA2 (0.34) | CA2 | |
| SCHEMBL16382514 | 0.69 | CA2 (0.34) | CA2 | |
| SCHEMBL8425951 | 0.68 | CHRM2 (0.44) | CHRM2CHRM4CHRM1CHRM3 |
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-RE46965-E1 | Intermediates for the preparation of analogs of Halichondrin B | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2018-07-24 | — | — | US | disclosed |