Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA9 | Q16790 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 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 | |
|---|---|---|---|---|
| SCHEMBL2923512 | 0.98 | CA12 (0.52) | CA12CA1CA2CA9MEN1 | |
| Ammonia Solution, Strong SCHEMBL28593728 | 0.95 | CA12 (0.50) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL3773495 | 0.95 | CA12 (0.50) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL1828127 | 0.90 | CA12 (0.59) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL6674040 | 0.79 | CA12 (0.38) | CA12CA1CA2CA9 | |
| SCHEMBL4758896 | 0.78 | CA12 (0.52) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL6285268 | 0.77 | CA12 (0.56) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL7594138 | 0.76 | CA12 (0.35) | CA12CA1CA2CA9 | |
| SCHEMBL11436182 | 0.76 | GRIN2D (0.53) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL7530271 | 0.73 | — | — |
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-5554699-A | USING BRANCHED N-ALKYLDITHIOCARBAMYL DERIVATIVE ACCELERATORS | THE B. F. GOODRICH COMPANY (US) | 1996-09-10 | — | — | US | disclosed |
| EP-0591632-A2 | Method of curing rubbers without forming nitrosamines | THE B.F. GOODRICH COMPANY (US) | 1994-04-13 | — | — | EP | disclosed |