Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.38 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16157005 | 0.80 | PDE3B (0.62) | PDE3BPDE3A | |
| SCHEMBL17446919 | 0.79 | PDE3B (0.46) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL8358594 | 0.68 | CA1 (0.61) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL15683644 | 0.67 | CA1 (0.59) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL25845301 | 0.65 | CA1 (0.61) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL8262169 | 0.65 | CA1 (0.61) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL1030597 | 0.65 | CA1 (0.66) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL31195399 | 0.65 | CA1 (0.61) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL17844353 | 0.65 | POLB (0.64) | CA1CA2CA6OPRK1CA7 | |
| SCHEMBL7972833 | 0.65 | CA1 (0.56) | CA1CA2CA6OPRK1CA7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2970145-B1 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CANCER | BROAD INST INC (US) | 2020-05-06 | — | — | EP | disclosed |