Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 17/20 | 1.00 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | CHKA | P35790 | 1/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.43 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16416618 | 0.90 | PARP1 (1.00) | PARP1 | |
| SCHEMBL16416284 | 0.89 | PARP1 (1.00) | PARP1 | |
| SCHEMBL31060448 | 0.89 | PARP1 (1.00) | PARP1 | |
| SCHEMBL16416563 | 0.87 | PARP1 (1.00) | PARP1 | |
| SCHEMBL16416339 | 0.72 | PARP1 (1.00) | PARP1 | |
| SCHEMBL16416385 | 0.71 | PARP1 (1.00) | PARP1 | |
| SCHEMBL6618181 | 0.70 | NOS1 (0.64) | PARP1CHKA | |
| SCHEMBL2906006 | 0.68 | HDAC6 (0.68) | PARP1CHEK1CHKA | |
| Hydrochloric Acid SCHEMBL4963320 | 0.68 | JAK2 (0.57) | PARP1CHKA | |
| SCHEMBL29817837 | 0.68 | PARP1 (0.59) | PARP1CHEK1CHKA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015011008-A1 | 7-AZAINDOLE DERIVATIVES AS PARP INHIBITORS | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2015-01-29 | — | — | WO | claimed |
| WO-2015011008-A1 | 7-AZAINDOLE DERIVATIVES AS PARP INHIBITORS | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 2015-01-29 | — | — | WO | disclosed |