Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | CA9 | Q16790 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21645745 | 0.73 | ALDH1A1 (0.39) | CYP1A2MAPK1PIK3CD | |
| SCHEMBL9316038 | 0.69 | CA12 (0.35) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL65000 | 0.67 | CYP1A2 (0.53) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL21574005 | 0.67 | CA12 (0.38) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL15039780 | 0.67 | — | — | |
| SCHEMBL5139662 | 0.65 | — | — | |
| SCHEMBL15469116 | 0.65 | CA12 (0.36) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL11832323 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL2139422 | 0.64 | CYP1A2 (0.50) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL91203 | 0.64 | — | — |
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-4283536-A | Preparation of vincadifformine and related derivatives | UNIVERSITY OF VERMONT (US) | 1981-08-11 | — | — | US | disclosed |